UV/Vis+ Photochemistry Database

Courtesy: Elisabeth Noelle Fund for Scientific Data Exchange (non omnis moriar)

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UV/Vis+ Photochemistry Database

Literature Service: Other Organic Oxygen Compounds (Other Oxygenated Organics)

Substances (unsorted):

CH3OH, CH3OD, CD3OH, CD3OD, C2H5OH, n-C3H7OH, i-C3H7OH, C4H9OH,, C4H10O, C5H12O, C6H14O, C5H10O, C6H12O, CH3-O-CH3, C2H5-O-C2H5, CH3OC2H5, CH3-O-C3H7, CH2=CHOCH=CH2,CH2=CHCOOCH3, H2C=C(CH3)COOCH3, CH2=CHCOOC2H5, (CH3)3COC(CH3)2CH2, CH2=CHOC2H5, C8H14O2, C6H12O, C8H14O, C8H14O3, C4H10O2, C4H10O4, (CH3)3COC(CH3)2CH2O2, CF3OH, C2H3F3O, CF3CH2CH2OH, (CF3)3COH, (CF3)2CHOH, (CF3)2C(OH)CH3, CF3(CH2)2CH2OH, CCl3OH, C2H3F3O, C2H4F2O, C3H4F4O, C3H3F5O, CHF2-O-CHF2, CHF2-O-CF3, CF3CH2-O-CH2CF3, C3H2ClF5O, , C3H2ClF5O, C4H7ClO, C5HF11O, C5H10O, C4F8O, C6F4O2, C2H4O , C3H6O, C3H8O2, C3H6O3, C5H10O3, C4H6O, C4H8O, C4H6O2, C4H8O2, C5H4O2, C5H10O, C6H8O, C6H10O, C6H12O, C6H14O, C7H6O, C8H6O, C11H10O, C6H4O2, C5H8O, C7H6O2, C8H8O2, C8H10O, C9H10O, C9H12O, C10H12O, C10H18O, C10H12O2, C10H14O2, C5H10O2, C7H8O2, C8H10O2, C8H10O3, C8H12O4, C8H12O6, C9H6O4, C9H8O2, C9H8O3, C10H6O2, C10H8O2, C11H10O4, C12H6O2, C12H10O2, C12H10O4, C12H12O4, C13H8O3, C13H8O4, C13H8O5, C13H8O6, C13H8O7, C13H10O, C13H10O2, C13H10O3, C13H12O2, C13H14O2, C13H16O5, C14H8O2, C14H10O, C14H10O2, C14H12O, C14H12O2, C14H12O3, C14H14O, C14H14O2, C14H14O3, C15H12O3, C14H22O, C15H10O2, C15H12O, C15H18O3, C15H10O4, C15H14O4, C15H16O, C15H16O2, C14H6O4, C14H6O6, C14H8O4, C15H16O4, C15H10O5, C15H9O5-, C15H10O7, C15H10O8, C15H14O6, C16H12O, C16H12O2, C16H12O4, C16H12O5, C17H12O2, C17H12O6, C18H14O5, C18H20O2, C18H22O2, C18H26O3, C19H16O2, C19H16O10, C19H16O9, C19H24O2, C19H28O2, C20H16O6, C20H22O3, C20H22O5, C21H22O9, C23H22O7, C26H30O10, C27H30O16, C27H42O3, C27H42O5, C27H44O, C27H44O2, C27H46O, C28H18O6, C29H20O2, C29H48O, C29H50O, C30H30O8, C30H48O3, C30H50O, C30H50O2, C30H50O3, C36H60O6, C40H56O2, C40H52O4, C40H56O4, C40H56O5

The relevant Spectral Data, graphical representations, links to abstracts and other photochemical data & information are available for registered users, see Subscription

Please note: The substance groups are only a rough classification. To search for a specific substance please use the Search Tool or see the Substance-list.

Substances unsorted, use your browser capabilities to search this site or use our Search Tool to search the database.

Authors Journal/Source Title/Paper Data Sheet
CH4O; CH3OH; methanol; methyl alcohol; CAS-No.: 67-56-1; PubChem: CID 887
M. Ogawa, G.R. Cook J. Chem. Phys., 28, 747-748, (1958) Absorption coefficients of methyl, ethyl, n-propyl, and n-butyl alcohols

A.J. Harrison, B.J. Cederholm, M.A. Terwilliger J. Chem. Phys., 30, 355-356, (1959) Absorption of Acyclic Oxygen Compounds in the Vacuum Ultraviolet. I. Alcohols

J.L. Weeks, G.M.A.C. Meaburn, S. Gordon Radiation Research, 19, 559-567, (1963) Absorption coefficients of liquid water and aqueous solutions in the far ultraviolet

H. Tsubomura, K. Kimura, K. Kaya, J. Tanaka, S. Nagakura Bull. Chem. Soc. Japan, 37 (3), 417-423, (1964) Vacuum Ultraviolet Absorption Spectra of Saturated Organic Compounds with Non-bonding Electrons

S.W. Bennett, J.B. Tellinghuisen, L.F. Phillips J. Phys. Chem., 75, 719-721, (1971) Absorption coefficients and ionization yields of some small molecules at 58.4 nm

D.R. Salahub, C. Sandorfy Chem. Phys. Lett., 8, 71-74, (1971) The far-ultraviolet spectra of some simple alcohols and fluoroalcohols

M.F. Fox, E. Hayon J. Phys. Chem., 76 (19), 2703-2706, (1972) Far-ultraviolet solvent spectroscopy

J.B. Nee, M. Suto, L.C. Lee Chem. Phys., 98, 147-155, (1985) Photoexcitation Processes of CH3OH: Rydberg States and Photofragment Fluorescence

G.R. Burton, W.F. Chan, G. Cooper, C.E. Brion Chem. Phys., 167, 349-367, (1992) Absolute oscillator strengths for photoabsorption (6-360 eV) and ionic photofragmentation (10-80 eV) of methanol

B.-M. Cheng, M. Bahou, W.-C. Chen, C.-H. Yui, Y.-P. Lee, L.C. Lee J. Chem. Phys., 117, 1633, (2002) Experimental and theoretical studies on vacuum ultraviolet absorption cross sections and photodissociation of CH3OH, CH3OD, CD3OH, and CD3OD

E. Jiménez, M.K. Gilles, A.R. Ravishankara J. Photochem. Photobiol. A: Chem., 157, 237-245, (2003) Kinetics of the reaction of the hydroxyl radical with CH3OH and C2H5OH between 235 and 360 K

Y.-P. Kuo, H.-C. Lu, Y.-J. Wu, B.-M. Cheng, J.F. Ogilvie Chem. Phys. Lett., 447, 168–174, (2007) Absorption spectra in the vacuum ultraviolet region of methanol in condensed phases

E. Lange, A.I. Lozano, N.C. Jones, S.V. Hoffmann, S. Kumar, M.A. Smialek, D. Duflot, M.J. Brunger, P. Limao-Vieira J. Phys. Chem., 124, 41, 8496–8508, (2020) Absolute Photoabsorption Cross-Sections of Methanol for Terrestrial and Astrophysical Relevance

related data (quantum yield studies; photolysis studies, etc.)
C. von Sonntag Tetrahedron, 25, 5853-5861, (1969) Strahlenchemie von alkoholen-IX. Die UV-photolyse (lambda = 185 nm) von methanol in flüssiger phase 

M. Lucas, Y. Liu, R. Bryant, J. Minor, J. Zhang Chem. Phys. Lett., 619, 18-22, (2015) Vacuum ultraviolet photodissociation dynamics of methanol at 121.6 nm

CH3DO; methan(2H)ol; methan(ol-d); CAS-No.: 1455-13-6; PubChem: 24879126
M.F. Fox, E. Hayon J. Phys. Chem., 76 (19), 2703-2706, (1972) Far-ultraviolet solvent spectroscopy

CHD3O; CD3OH; methanol-d3; CAS-No.: 1849-29-2
B.-M. Cheng, M. Bahou, Y.-P. Lee, L.C. Lee J. Geophys. Res., 107, 11611165, (2002) Absorption cross sections and solar photodissociation rates of deuterated isotopomers of methanol

CD4O; CD3OD; methanol-d4; tetradeuteromethanol; CAS-No.: 811-98-3; PubChem: 24879041
M.F. Fox, E. Hayon J. Phys. Chem., 76 (19), 2703-2706, (1972) Far-ultraviolet solvent spectroscopy

C2H6O; C2H5OH; ethanol; CAS-No.: 64-17-5; PubChem: CID 702
M. Ogawa, G.R. Cook J. Chem. Phys., 28, 747-748, (1958) Absorption coefficients of methyl, ethyl, n-propyl, and n-butyl alcohols

A.J. Harrison, B.J. Cederholm, M.A. Terwilliger J. Chem. Phys., 30, 355-356, (1959) Absorption of Acyclic Oxygen Compounds in the Vacuum Ultraviolet. I. Alcohols

H. Tsubomura, K. Kimura, K. Kaya, J. Tanaka, S. Nagakura Bull. Chem. Soc. Japan, 37 (3), 417-423, (1964) Vacuum Ultraviolet Absorption Spectra of Saturated Organic Compounds with Non-bonding Electrons

D.R. Salahub, C. Sandorfy Chem. Phys. Lett., 8, 71-74, (1971) The far-ultraviolet spectra of some simple alcohols and fluoroalcohols

S.W. Bennett, J.B. Tellinghuisen, L.F. Phillips J. Phys. Chem., 75, 719-721, (1971) Absorption coefficients and ionization yields of some small molecules at 58.4 nm

H. Koizumi, K. Hironaka, K. Shinsaka, A. Shin, H. Nakazawa, A. Kimura, Y. Hatano, Y. Ito, Y. Zhang, A. Yagishita, K. Ito, K. Tanaka J. Chem. Phys., 85, 4276-4279, (1986) VUV-optical oscillator strength distributions of C2H6O and C3H8O isomers

J.C. Han, M. Suto, L.C. Lee J. Quant. Spectrosc. Radiat. Transfer, 42, 557-562, (1989) Fluorescence from photoexcitation of C2H5OH by vacuum ultraviolet radiation

R. Feng, C.E. Brion Chem. Phys., 282, 419-427, (2002) Absolute photoabsorption cross-sections (oscillator strengths) for ethanol (5-200 eV)

A. Grosch, V. Beushausen, H. Wackerbarth, O. Thiele, T. Berg Applied Optics, 49 (2), 196 - 203, (2010) Temperature- and pressure-dependent midinfrared absorption cross sections of gaseous hydrocarbons

A. Souza Barbosa, M. Mendes, N.C. Jones, S.V. Hoffmann, M.H.F. Bettega, M.J. Brunger, P. Limao-Vieira J. Quant. Spectr. Rad. Transfer, 285, 108170, (2022) Low-lying electronic states of ethanol investigated by theoretical and synchrotron radiation methods

A.C. Doner, H.A. Moran, A.R. Webb, M.G. Christanson, A.L. Koritzke, N.S. Dewey, S.W. Hartness, B. Rotavera J. Quant. Spectr. Rad. Transfer, 297, 108438, (2023) Machine learning models for binary molecular classification using VUV absorption spectra

C2H6O; ethanol-d6; CAS-No.: 1516-08-1; PubChem: CID 102138
A.C. Doner, H.A. Moran, A.R. Webb, M.G. Christanson, A.L. Koritzke, N.S. Dewey, S.W. Hartness, B. Rotavera J. Quant. Spectr. Rad. Transfer, 297, 108438, (2023) Machine learning models for binary molecular classification using VUV absorption spectra

C3H8O; C3H7OH; n-propanol; 1-propanol; n-propyl alcohol; CAS-No.: 71-23-8; PubChem: CID 1031
M. Ogawa, G.R. Cook J. Chem. Phys., 28, 747-748, (1958) Absorption Coefficients of Methyl, Ethyl, n-Propyl, and n-Butyl Alcohols

A.J. Harrison, B.J. Cederholm, M.A. Terwilliger J. Chem. Phys., 30, 355-356, (1959) Absorption of acyclic oxygen compounds in the vacuum ultraviolet. I. Alcohols

D.R. Salahub, C. Sandorfy Chem. Phys., Lett. 8, 71-74, (1971) The far-ultraviolet spectra of some simple alcohols and fluoroalcohols

H. Koizumi, K. Hironaka, K. Shinsaka, A. Shin, H. Nakazawa, A. Kimura, Y. Hatano, Y. Ito, Y. Zhang, A. Yagishita, K. Ito, K. Tanaka J. Chem. Phys., 85, 4276-4279, (1986) VUV-optical oscillator strength distributions of C2H6O and C3H8O isomers

B. Rajakumar, D.C. McCabe, R.K. Talukdar, A.R. Ravishankara Int. J. Chem. Kin., 42 (1), 10-24, (2010) Rate coefficients for the reactions of OH with n-propanol and iso-propanol between 237 and 376 K

A.C. Doner, H.A. Moran, A.R. Webb, M.G. Christanson, A.L. Koritzke, N.S. Dewey, S.W. Hartness, B. Rotavera J. Quant. Spectr. Rad. Transfer, 297, 108438, (2023) Machine learning models for binary molecular classification using VUV absorption spectra

C3H8O; i-propanol; iso-propyl alcohol; CAS-No.: 67-63-0
A.J. Harrison, B.J. Cederholm, M.A. Terwilliger J. Chem. Phys., 30, 355-356, (1959) Absorption of Acyclic Oxygen Compounds in the Vacuum Ultraviolet. I. Alcohols

S.W. Bennett, J.B. Tellinghuisen, L.F. Phillips J. Phys. Chem., 75, 719-721, (1971) Absorption coefficients and ionization yields of some small molecules at 58.4 nm

H. Koizumi, K. Hironaka, K. Shinsaka, S. Arai, H. Nakazawa, A. Kimura, Y. Hatano, Y. Ito, Y. Zhang, A. Yagishita, K. Ito, K. Tanaka J. Chem. Phys., 85, 4276-4279, (1986) VUV-optical oscillator strength distributions of C2H6O and C3H8O isomers

B. Rajakumar, D.C. McCabe, R.K. Talukdar, A.R. Ravishankara Int. J. Chem. Kin., 42 (1), 10-24, (2010) Rate coefficients for the reactions of OH with n-propanol and iso-propanol between 237 and 376 K

V.L. Orkin, V.G. Khamaganov, M.J. Kurylo J. Phys. Chem. A, 116 (24), 6188-6198, (2012) High Accuracy Measurements of OH Reaction Rate Constants and IR Absorption Spectra: Substituted 2-Propanols

C4H9OH; C4H10O; 1-butanol; n-butanol; n-butyl alcohol; CAS-No.: 71-36-3; PubChem: CID 263
M. Ogawa, G.R. Cook J. Chem. Phys., 28, 747-748, (1958) Absorption Coefficients of Methyl, Ethyl, n-Propyl, and n-Butyl Alcohols

A.C. Doner, A.R. Webb, N.S. Dewey, S.W. Hartness, M.G. Christianson, A.L. Koritzke, A. Larsson, K.M. Frandsen, B. Rotavera J. Quant. Spectr. Rad. Transfer, 292, 108346, (2022) Vacuum-ultraviolet absorption cross-sections of functionalized four-carbon species

A.C. Doner, H.A. Moran, A.R. Webb, M.G. Christanson, A.L. Koritzke, N.S. Dewey, S.W. Hartness, B. Rotavera J. Quant. Spectr. Rad. Transfer, 297, 108438, (2023) Machine learning models for binary molecular classification using VUV absorption spectra

C4H10O; 2-butanol; CAS-No.: 78-92-2
E. Jiménez, B. Lanza, A. Garzón, B. Ballesteros, J. Albaladejo J. Phys. Chem. A, 109 (48), 10903 -10909, (2005) Atmospheric Degradation of 2-Butanol, 2-Methyl-2-butanol, and 2,3-Dimethyl-2-butanol: OH Kinetics and UV Absorption Cross Sections

C4H10O; (S)-(+)-2-butanol; (S)-butan-2-ol; (S)-2-butanol; CAS-No.: 4221-99-2; PubChem: CID 444683
A.C. Doner, H.A. Moran, A.R. Webb, M.G. Christanson, A.L. Koritzke, N.S. Dewey, S.W. Hartness, B. Rotavera J. Quant. Spectr. Rad. Transfer, 297, 108438, (2023) Machine learning models for binary molecular classification using VUV absorption spectra

C4H10O; (R)-(-)-2-butanol; (R)-butan-2-ol; (R)-2-butanol; CAS-No.: 14898-79-4; PubChem: CID 84682
A.C. Doner, H.A. Moran, A.R. Webb, M.G. Christanson, A.L. Koritzke, N.S. Dewey, S.W. Hartness, B. Rotavera J. Quant. Spectr. Rad. Transfer, 297, 108438, (2023) Machine learning models for binary molecular classification using VUV absorption spectra

C5H12O; 2-methyl-2-butanol; CAS-No.: 75-85-4
E. Jiménez, B. Lanza, A. Garzón, B. Ballesteros, J. Albaladejo J. Phys. Chem. A, 109 (48), 10903 -10909, (2005) Atmospheric Degradation of 2-Butanol, 2-Methyl-2-butanol, and 2,3-Dimethyl-2-butanol: OH Kinetics and UV Absorption Cross Sections

C6H14O; 2,3-dimethyl-2-butanol; CAS-No.: 594-60-5
E. Jiménez, B. Lanza, A. Garzón, B. Ballesteros, J. Albaladejo J. Phys. Chem. A, 109 (48), 10903 -10909, (2005) Atmospheric Degradation of 2-Butanol, 2-Methyl-2-butanol, and 2,3-Dimethyl-2-butanol: OH Kinetics and UV Absorption Cross Sections

C5H10O; 1-penten-3-ol; CAS-No.: 616-25-1
E. Jimenez, B. Lanza, M. Antiñolo, J. Albaladejo Environ. Sci. Technol., 43 (6), 1831-1837, (2009) Photooxidation of Leaf-Wound Oxygenated Compounds, 1-Penten-3-ol, (Z)-3-Hexen-1-ol, and 1-Penten-3-one, Initiated by OH Radicals and Sunlight

M.E. Davis, J.B. Burkholder Atmos. Chem. Phys., 11, 3347-3358, (2011) Rate coefficients for the gas-phase reaction of OH with (Z)-3-hexen-1-ol, 1-penten-3-ol, (E)-2-penten-1-ol, and (E)-2-hexen-1-ol between 243 and 404K

C5H10O; 3-methyl-2-buten-1-ol; prenol; 3,3-dimethylallyl alcohol; CAS-No.: 556-82-1; PubChem: CID 11173
A.C. Doner, H.A. Moran, A.R. Webb, M.G. Christanson, A.L. Koritzke, N.S. Dewey, S.W. Hartness, B. Rotavera J. Quant. Spectr. Rad. Transfer, 297, 108438, (2023) Machine learning models for binary molecular classification using VUV absorption spectra

C5H10O; 3-methyl-3-buten-1-ol; isoprenol; 3-methylbut-3-en-1-ol; CAS-No.: 763-32-6; PubChem: CID 12988
A.C. Doner, H.A. Moran, A.R. Webb, M.G. Christanson, A.L. Koritzke, N.S. Dewey, S.W. Hartness, B. Rotavera J. Quant. Spectr. Rad. Transfer, 297, 108438, (2023) Machine learning models for binary molecular classification using VUV absorption spectra

C5H10O; 3,3-dimethyloxetane; 3,3-dimethyltrimethylene oxide; CAS-No.: 6921-35-3; PubChem: CID 23352
A.C. Doner, H.A. Moran, A.R. Webb, M.G. Christanson, A.L. Koritzke, N.S. Dewey, S.W. Hartness, B. Rotavera J. Quant. Spectr. Rad. Transfer, 297, 108438, (2023) Machine learning models for binary molecular classification using VUV absorption spectra

C5H10O; 2,3-epoxypentane; 2-ethyl-3-methyloxirane; CAS-No.: 4016-15-3; PubChem: CID 520554
A.C. Doner, H.A. Moran, A.R. Webb, M.G. Christanson, A.L. Koritzke, N.S. Dewey, S.W. Hartness, B. Rotavera J. Quant. Spectr. Rad. Transfer, 297, 108438, (2023) Machine learning models for binary molecular classification using VUV absorption spectra

C5H10O; 1,2-epoxypentane; 2-propyloxirane; CAS-No.: 1003-14-1; PubChem: CID 13853
A.C. Doner, H.A. Moran, A.R. Webb, M.G. Christanson, A.L. Koritzke, N.S. Dewey, S.W. Hartness, B. Rotavera J. Quant. Spectr. Rad. Transfer, 297, 108438, (2023) Machine learning models for binary molecular classification using VUV absorption spectra

C5H10O; (E)-2-penten-1-ol; CAS-No.: 1576-96-1
M.E. Davis, J.B. Burkholder Atmos. Chem. Phys., 11, 3347-3358, (2011) Rate coefficients for the gas-phase reaction of OH with (Z)-3-hexen-1-ol, 1-penten-3-ol, (E)-2-penten-1-ol, and (E)-2-hexen-1-ol between 243 and 404K

C5H10O; tetrahydropyran; tetrahydro-2H-pyran; CAS-No.: 142-68-7; PubChem: CID 8894
B. Yang, J. Wang, T.A. Cool, N. Hansen, S. Skeen, D.L. Osborn Int. J. Mass Spectr., 309, 118-128, (2012) Absolute photoionization cross-sections of some combustion intermediates

A.C. Doner, M.G. Christianson, J.C. Davis, A.L. Koritzke, A. Larsson, K. Frandsen, B. Rotavera J. Quant. Spectr. Rad. Transfer, 236, 106603, (2019) Vacuum-ultraviolet absorption cross-sections of functionalized cyclic hydrocarbons: Six-membered rings

J.C. Davis, A.L. Koritzke, R.L. Caravan, I.O. Antonov, M.G. Christianson, A.C. Doner, D.L. Osborn, L.Sheps, C.A. Taatjes, B. Rotavera J. Phys. Chem. A, 123, 17, 3634–3646, (2019) Influence of Ether Functional Group on Ketohydroperoxide Formation in Cyclic Hydrocarbons: Tetrahydropyran and Cyclohexane

A.C. Doner, H.A. Moran, A.R. Webb, M.G. Christanson, A.L. Koritzke, N.S. Dewey, S.W. Hartness, B. Rotavera J. Quant. Spectr. Rad. Transfer, 297, 108438, (2023) Machine learning models for binary molecular classification using VUV absorption spectra

C5H10O; cyclopentanol; cyclopentyl alcohol; CAS-No.: 96-41-3; PubChem: CID 7298
M.G. Christianson, A.C. Doner, A.L. Koritzke, K. Frandsen, B. Rotavera J. Quant. Spectr. Rad. Transfer, 258, 107274, (2021) Vacuum-Ultraviolet Absorption Cross-Sections of Functionalized Cyclic Hydrocarbons: Five-Membered Rings

A.C. Doner, H.A. Moran, A.R. Webb, M.G. Christanson, A.L. Koritzke, N.S. Dewey, S.W. Hartness, B. Rotavera J. Quant. Spectr. Rad. Transfer, 297, 108438, (2023) Machine learning models for binary molecular classification using VUV absorption spectra

C6H12O; (Z)-3-hexen-1-ol; cis-3-hexen-1-ol; CAS-No.: 928-96-1
E. Jimenez, B. Lanza, M. Antiñolo, J. Albaladejo Environ. Sci. Technol., 43 (6), 1831-1837, (2009) Photooxidation of Leaf-Wound Oxygenated Compounds, 1-Penten-3-ol, (Z)-3-Hexen-1-ol, and 1-Penten-3-one, Initiated by OH Radicals and Sunlight

M.E. Davis, J.B. Burkholder Atmos. Chem. Phys., 11, 3347-3358, (2011) Rate coefficients for the gas-phase reaction of OH with (Z)-3-hexen-1-ol, 1-penten-3-ol, (E)-2-penten-1-ol, and (E)-2-hexen-1-ol between 243 and 404K

C6H12O; (E)-2-hexen-1-ol; CAS-No.: 928-95-0
M.E. Davis, J.B. Burkholder Atmos. Chem. Phys., 11, 3347-3358, (2011) Rate coefficients for the gas-phase reaction of OH with (Z)-3-hexen-1-ol, 1-penten-3-ol, (E)-2-penten-1-ol, and (E)-2-hexen-1-ol between 243 and 404K

C2H6O; CH3-O-CH3; dimethyl ether; methoxymethane; CAS-No.: 115-10-6; PubChem: CID 8254
A.J. Harrison, D.R.W. Rice J. Chem. Phys., 30, 357-360, (1959) Absorption of Acyclic Oxygen Compounds in the Vacuum Ultraviolet. II. Ethers

H. Koizumi, K. Hironaka, K. Shinsaka, S. Arai, H. Nakazawa, A. Kimura, Y. Hatano, Y. Ito, Y. Zhang, A. Yagishita, K. Ito, K. Tanaka J. Chem. Phys., 85, 4276-4279, (1986) VUV-optical oscillator strength distributions of C2H6O and C3H8O isomers

L.J. Bremner, M.G. Curtis, I.C. Walker J. Chem. Soc. Faraday Trans., 87, 1049-1055, (1991) Electronic states of some simple ethers studied by vacuum ultraviolet absorption and near-threshold electron energy-loss spectroscopy

V.L. Orkin, E. Villenave, R.E. Huie, M.J. Kurylo J. Phys. Chem., A, 103, 9770-9779, (1999) Atmospheric Lifetimes and Global Warming Potentials of Hydrofluoroethers: Reactivity toward OH, UV Spectra, and IR Absorption Cross Sections

R. Feng, G. Cooper C.E. Brion Chemical Physics, 260, 391-400, (2000) UV, VUV and soft X-ray photoabsorption of dimethyl ether by dipole (e,e) spectroscopies

A.C. Doner, H.A. Moran, A.R. Webb, M.G. Christanson, A.L. Koritzke, N.S. Dewey, S.W. Hartness, B. Rotavera J. Quant. Spectr. Rad. Transfer, 297, 108438, (2023) Machine learning models for binary molecular classification using VUV absorption spectra

C4H10O; C2H5-O-C2H5; diethyl ether; ethoxyethane; CAS-No.: 60-29-7; PubChem: CID 3283
A.J. Harrison, D.R.W. Rice J. Chem. Phys., 30, 357-360, (1959) Absorption of Acyclic Oxygen Compounds in the Vacuum Ultraviolet. II. Ethers

H. Tsubomura, K. Kimura, K. Kaya, J. Tanaka, S. Nagakura Bull. Chem. Soc. Japan, 37 (3), 417-423, (1964) Vacuum Ultraviolet Absorption Spectra of Saturated Organic Compounds with Non-bonding Electrons

L.J. Bremner, M.G. Curtis, I.C. Walker J. Chem. Soc. Faraday Trans., 87, 1049-1055, (1991) Electronic states of some simple ethers studied by vacuum ultraviolet absorption and near-threshold electron energy-loss spectroscopy

V.L. Orkin, E. Villenave, R.E. Huie, M.J. Kurylo J. Phys. Chem., A, 103, 9770-9779, (1999) Atmospheric Lifetimes and Global Warming Potentials of Hydrofluoroethers: Reactivity toward OH, UV Spectra, and IR Absorption Cross Sections

R. Feng, C.E. Brion Chemical Physics, 284, 615-623, (2002) Quantitative photoabsorption of diethyl ether in the valence and carbon 1s inner shell regions (5–360 eV) 

A.C. Doner, A.R. Webb, N.S. Dewey, S.W. Hartness, M.G. Christianson, A.L. Koritzke, A. Larsson, K.M. Frandsen, B. Rotavera J. Quant. Spectr. Rad. Transfer, 292, 108346, (2022) Vacuum-ultraviolet absorption cross-sections of functionalized four-carbon species

A.C. Doner, H.A. Moran, A.R. Webb, M.G. Christanson, A.L. Koritzke, N.S. Dewey, S.W. Hartness, B. Rotavera J. Quant. Spectr. Rad. Transfer, 297, 108438, (2023) Machine learning models for binary molecular classification using VUV absorption spectra

C3H8O; CH3OC2H5; methyl ethyl ether; CAS-No.: 540-67-0
H. Koizumi, K. Hironaka, K. Shinsaka, A. Shin, H. Nakazawa, A. Kimura, Y. Hatano, Y. Ito, Y. Zhang, A. Yagishita, K. Ito, K. Tanaka J. Chem. Phys., 85, 4276-4279, (1986) VUV-optical oscillator strength distributions of C2H6O and C3H8O isomers

C4H10O; CH3-O-C3H7; methyl propyl ether; 1-methoxypropane; CAS-No.: 557-17-5; PubChem: CID 11182
H.-P. Schuchmann, C. von Sonntag Zeitschrift Naturforschung B, 30 (5), 399-403, (1975) The Photolysis (lambda = 185 nm) of Liquid Methyl n-Propyl Ether

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C4H6O; CH2=CHOCH=CH2; divinyl ether; CAS-No.: 109-93-3
A.J. Harrison, C.L. Gaddis, E.M. Coffin J. Chem. Phys., 18, 221-223, (1950) Quantitative Determination of Extinction Coefficients in the Vacuum Ultraviolet: Divinyl Ether

A.J. Harrison, D.R.W. Rice J. Chem. Phys., 30, 357-360, (1959) Absorption of Acyclic Oxygen Compounds in the Vacuum Ultraviolet. II. Ethers

C4H8O; CH2=CHOC2H5; ethyl vinyl ether; ethoxyethene; CAS-No.: 109-92-2; PubChem: CID 8023
L.I. Nieto-Gligorovski, S. Gligorovski, R. Romano, C. Della Vedova, C. Zetzsch J. Photochem. Photobiol. A: Chem., 204, 46-51, (2009) UV absorption cross-sections of a series of vinyl ethers

A.C. Doner, A.R. Webb, N.S. Dewey, S.W. Hartness, M.G. Christianson, A.L. Koritzke, A. Larsson, K.M. Frandsen, B. Rotavera J. Quant. Spectr. Rad. Transfer, 292, 108346, (2022) Vacuum-ultraviolet absorption cross-sections of functionalized four-carbon species

A.C. Doner, H.A. Moran, A.R. Webb, M.G. Christanson, A.L. Koritzke, N.S. Dewey, S.W. Hartness, B. Rotavera J. Quant. Spectr. Rad. Transfer, 297, 108438, (2023) Machine learning models for binary molecular classification using VUV absorption spectra

C8H14O2; 1,4-butanediol divinyl ether; CAS-No.: 3891-33-6
L.I. Nieto-Gligorovski, S. Gligorovski, R. Romano, C. Della Vedova, C. Zetzsch J. Photochem. Photobiol. A: Chem., 204, 46-51, (2009) UV absorption cross-sections of a series of vinyl ethers

C6H12O; isobutyl vinyl ether; CAS-No.: 109-53-5
L.I. Nieto-Gligorovski, S. Gligorovski, R. Romano, C. Della Vedova, C. Zetzsch J. Photochem. Photobiol. A: Chem., 204, 46-51, (2009) UV absorption cross-sections of a series of vinyl ethers

C8H14O; cyclohexyl vinyl ether; CAS-No.: 2182-55-0
L.I. Nieto-Gligorovski, S. Gligorovski, R. Romano, C. Della Vedova, C. Zetzsch J. Photochem. Photobiol. A: Chem., 204, 46-51, (2009) UV absorption cross-sections of a series of vinyl ethers

C8H14O3; diethyleneglycol divinyl ether; CAS-No.: 764-99-8
L.I. Nieto-Gligorovski, S. Gligorovski, R. Romano, C. Della Vedova, C. Zetzsch J. Photochem. Photobiol. A: Chem., 204, 46-51, (2009) UV absorption cross-sections of a series of vinyl ethers

C4H10O2; dimethoxyethane; 1,2-dimethoxyethane; dimethyl glycol; DME; CAS-No.: 110-71-4
M.F. Fox, E. Hayon J. Phys. Chem., 76 (19), 2703-2706, (1972) Far-ultraviolet solvent spectroscopy

C4H10O4; erythritol; meso-erythritol; erythrit; meso-1,2,3,4-butantetrol; CAS-No.: 149-32-6; PubChem: CID 222285
L.N. Tran, K.A. Abellar, J.D. Cope, T.B. Nguyen J. Phys. Chem. A, 126, 37, 6517–6525, (2022) Second-Order Kinetic Rate Coefficients for the Aqueous-Phase Sulfate Radical (SO4•–) Oxidation of Some Atmospherically Relevant Organic Compounds

C4H6O2; CH2=CHCOOCH3; methyl acrylate; CAS-No.: 96-33-3
M.A. Teruel, S.I. Lane, A. Mellouki, G. Solignac, G. Le Bras Atmos. Environ., 40, 3764-3772, (2006) OH reaction rate constants and UV absorption cross-sections of unsaturated esters

C5H8O2; H2C=C(CH3)COOCH3; methyl methacrylate; CAS-No.: 80-62-6
M.A. Teruel, S.I. Lane, A. Mellouki, G. Solignac, G. Le Bras Atmos. Environ., 40, 3764-3772, (2006) OH reaction rate constants and UV absorption cross-sections of unsaturated esters

C5H8O2; CH2=CHCOOC2H5; ethyl acrylate; CAS-No.: 140-88-5
M.A. Teruel, S.I. Lane, A. Mellouki, G. Solignac, G. Le Bras Atmos. Environ., 40, 3764-3772, (2006) OH reaction rate constants and UV absorption cross-sections of unsaturated esters

C8H17O; (CH3)3COC(CH3)2CH2; alkyl radical
O.J. Nielsen, J. Sehested, S. Langer, E. Ljungström, I. Wängberg Chem. Phys. Lett., 238, 359-364, (1995) UV absorption spectra and kinetics for alkyl and alkyl peroxy radicals originating from di-tert-butyl ether

C8H17O3; (CH3)3COC(CH3)2CH2O2; alkyl peroxy radical
O.J. Nielsen, J. Sehested, S. Langer, E. Ljungström, I. Wängberg Chem. Phys. Lett., 238, 359-364, (1995) UV absorption spectra and kinetics for alkyl and alkyl peroxy radicals originating from di-tert-butyl ether

CHF3O; CF3OH; trifluoromethanol; CAS-No.: 1493-11-4
L.T. Molina, M.J. Molina Geophys. Res. Lett., 23, 563-565, (1996) Ultraviolet spectrum of CF3OH: Upper limits to the absorption cross section

C2H3F3O; trifluoro ethanol; 2,2,2-trifluoroethanol; trifluoroethyl alcohol; TFE; CAS-No.: 75-89-8; PubChem: 6409
M.F. Fox, E. Hayon J. Phys. Chem., 76 (19), 2703-2706, (1972) Far-ultraviolet solvent spectroscopy

CF3CH2CH2OH; 3,3,3-trifluoro-1-propanol; CAS-No.: 2240-88-2
E. Jiménez, M. Antiñolo, B. Ballesteros, E. Martínez, J. Albaladejo ChemPhysChem, 11 (18), 4079-4087, (2010) Atmospheric Lifetimes and Global Warming Potentials of CF3CH2CH2OH and CF3(CH2)2CH2OH

C4HF9O; (CF3)3COH; 1,1,1,3,3,3-hexafluoro-2-(trifluoromethyl)-2-propanol; CAS-No.: 2378-02-1
V.L. Orkin, V.G. Khamaganov, M.J. Kurylo J. Phys. Chem. A, 116 (24), 6188-6198, (2012) High Accuracy Measurements of OH Reaction Rate Constants and IR Absorption Spectra: Substituted 2-Propanols

C3H2F6O; (CF3)2CHOH; 1,1,1,3,3,3-hexafluoro-2-propanol; hexafluoroisopropanol; CAS-No.: 920-66-1; PubChem: 13529
M.F. Fox, E. Hayon J. Phys. Chem., 76 (19), 2703-2706, (1972) Far-ultraviolet solvent spectroscopy

V.L. Orkin, V.G. Khamaganov, M.J. Kurylo J. Phys. Chem. A, 116 (24), 6188-6198, (2012) High Accuracy Measurements of OH Reaction Rate Constants and IR Absorption Spectra: Substituted 2-Propanols

C4H4F6O; (CF3)2C(OH)CH3; 1,1,1,3,3,3-hexafluoro-2-methyl-2-propanol; CAS-No.: 1515-14-6
V.L. Orkin, V.G. Khamaganov, M.J. Kurylo J. Phys. Chem. A, 116 (24), 6188-6198, (2012) High Accuracy Measurements of OH Reaction Rate Constants and IR Absorption Spectra: Substituted 2-Propanols

C4H7F3O; CF3(CH2)2CH2OH; 4,4,4-trifluorobutanol; CAS-No.: 461-18-7
E. Jiménez, M. Antiñolo, B. Ballesteros, E. Martínez, J. Albaladejo ChemPhysChem, 11 (18), 4079-4087, (2010) Atmospheric Lifetimes and Global Warming Potentials of CF3CH2CH2OH and CF3(CH2)2CH2OH

CHCl3O; CCl3OH; trichloromethanol; CAS-No.: 35911-92-3; PubChem: CID 6452003
related data (quantum yield studies; photolysis studies; ir studies, etc.)
T.J. Wallington, W.F. Schneider, I. Barnes, K.H. Becker, J. Sehested, O.J. Nielsen Chem. Phys. Lett., 322, 97-102, (2000) Stability and infrared spectra of mono-, di-, and trichloromethanol 

C2H3F3O; CH3OCF3; methyl trifluoromethyl ether; trifluoromethoxymethane; HFE-143a; CAS-No.: 421-14-7
V.L. Orkin, V.G. Khamaganov, A.G. Guschin J. Phys. Chem. A, 118 (45), 10770-10777, (2014) Photochemical Properties of Hydrofluoroethers CH3OCHF2, CH3OCF3, and CHF2OCH2CF3: Reactivity toward OH, IR Absorption Cross Sections, Atmospheric Lifetimes, and Global Warming Potentials

C2H4F2O; CH3OCHF2; difluoromethyl ether Other Names: difluoromethoxymethane; HFE-152a
V.L. Orkin, V.G. Khamaganov, A.G. Guschin J. Phys. Chem. A, 118 (45), 10770-10777, (2014) Photochemical Properties of Hydrofluoroethers CH3OCHF2, CH3OCF3, and CHF2OCH2CF3: Reactivity toward OH, IR Absorption Cross Sections, Atmospheric Lifetimes, and Global Warming Potentials

C3H4F4O; 2,2,3,3-tetrafluoropropanol; TFPO; CAS-No.: 76-37-9
M. Antinolo, S. Gonzalez, B. Ballesteros, J. Albaladejo, E. Jimenez J. Phys. Chem. A, 116, 6041-6050, (2012) Laboratory Studies of CHF2CF2CH2OH and CF3CF2CH2OH: UV and IR Absorption Cross Sections and OH Rate Coefficients between 263 and 358 K

C3H3F5O; 2,2,3,3,3-pentafluoropropanol; PFPO; CAS-No.: 422-05-9
M. Antinolo, S. Gonzalez, B. Ballesteros, J. Albaladejo, E. Jimenez J. Phys. Chem. A, 116, 6041-6050, (2012) Laboratory Studies of CHF2CF2CH2OH and CF3CF2CH2OH: UV and IR Absorption Cross Sections and OH Rate Coefficients between 263 and 358 K

C3H3F5O; CHF2OCH2CF3; 2-difluoromethoxy-1,1,1-trifluoro-ethane; 2-(difluoromethoxy)-1,1,1-trifluoroethane; HFE-245fa2; CAS-No.: 1885-48-9
V.L. Orkin, V.G. Khamaganov, A.G. Guschin J. Phys. Chem. A, 118 (45), 10770-10777, (2014) Photochemical Properties of Hydrofluoroethers CH3OCHF2, CH3OCF3, and CHF2OCH2CF3: Reactivity toward OH, IR Absorption Cross Sections, Atmospheric Lifetimes, and Global Warming Potentials

C2H2F4O; CHF2-O-CHF2; 1,1,1',1'-tetrafluorodimethyl ether; CAS-No.: 1691-17-4
V.L. Orkin, E. Villenave, R.E. Huie, M.J. Kurylo J. Phys. Chem., A, 103, 9770-9779, (1999) Atmospheric Lifetimes and Global Warming Potentials of Hydrofluoroethers: Reactivity toward OH, UV Spectra, and IR Absorption Cross Sections

C2HF5O; CHF2-O-CF3; pentafluorodimethyl ether; CAS-No.: 3822-68-2
V.L. Orkin, E. Villenave, R.E. Huie, M.J. Kurylo J. Phys. Chem., A, 103, 9770-9779, (1999) Atmospheric Lifetimes and Global Warming Potentials of Hydrofluoroethers: Reactivity toward OH, UV Spectra, and IR Absorption Cross Sections

C4H4F6O; CF3CH2-O-CH2CF3; flurothyl; CAS-No.: 333-36-8
V.L. Orkin, E. Villenave, R.E. Huie, M.J. Kurylo J. Phys. Chem., A, 103, 9770-9779, (1999) Atmospheric Lifetimes and Global Warming Potentials of Hydrofluoroethers: Reactivity toward OH, UV Spectra, and IR Absorption Cross Sections

C3H2ClF5O; ethane, 2-chloro-1-(difluoromethoxy)-1,1,2-trifluoro-; enflurane; CAS-No.: 13838-16-9
T. Langbein, H. Sonntag, D. Trapp, A. Hoffmann, W. Malms, E.-P. Röth, V. Mörs, R. Zellner British Journal of Anaesthesia, 82 (1), 66-73, (1999) Volatile anaesthetics and the atmosphere: atmospheric lifetimes and atmospheric effects of halothane, enflurane, isoflurane, desflurane and sevoflurane

C3H2ClF5O; 1-chloro-2,2,2-trifluoroethyl difluoromethyl ether; isoflurane; CAS-No.: 26675-46-7; PubChem: CID 3763
T. Langbein, H. Sonntag, D. Trapp, A. Hoffmann, W. Malms, E.-P. Röth, V. Mörs, R. Zellner British Journal of Anaesthesia, 82 (1), 66-73, (1999) Volatile anaesthetics and the atmosphere: atmospheric lifetimes and atmospheric effects of halothane, enflurane, isoflurane, desflurane and sevoflurane

E. Lange, F. Ferreira da Silva, N.C. Jones, S.V. Hoffmann, D. Duflot, P. Limao-Vieira Chem. Phys. Lett., 716, 42-48, (2019) The lowest-lying electronic states of isoflurane and sevoflurane in the 5.0-10.8 eV energy range investigated by experimental and theoretical methods

C4H7ClO; 2-chloroethyl vinyl ether; (2-chloroethoxy)ethene; CAS-No.: 110-75-8; PubChem: CID 8074
M. Antiñolo, A.J. Ocaña, J.P. Aranguren, S.I. Lane, J. Albaladejo, E. Jiménez Chemosphere, 181, 232-240, (2017) Atmospheric degradation of 2-chloroethyl vinyl ether, allyl ether and allyl ethyl ether: Kinetics with OH radicals and UV photochemistry

C5HF11O; heptafluoropropyl 1,2,2,2-tetrafluoroethyl ether; freon E1; CAS-No.: 3330-15-2
A.H. Hardin, C. Sandorfy J. Fluorine Chem., 5 (5), 435-442, (1975) Photoelectron and vacuum ultraviolet spectra of a series of fluoroethers

C5H10O; perfluoro (propyl vinyl ether); heptafluoropropyl trifluorovinyl ether; PPVE; CAS-No.: 1623-05-8
D. Amedro, L. Vereecken, J.N. Crowley Phys.Chem.Chem.Phys., 17, 18558-18566, (2015) Kinetics and mechanism of the reaction of perfluoro propyl vinyl ether (PPVE, C3F7OCH=CH2) with OH: assessment of its fate in the atmosphere

C4F8O; octafluorotetrahydrofuran; octafluorooxolane; CAS-No.: 773-14-8; PubChem: CID 164733
M.K. Vollmer, F. Bernard, B. Mitrevski, L.P. Steele, C.M. Trudinger, S. Reimann, R.L. Langenfelds, P.B. Krummel, P.J. Fraser, D.M. Etheridge, M.A.J. Curran, J.B. Burkholder Atmos. Chem. Phys., 19, 3481-3492, (2019) Abundances, emissions, and loss processes of the long-lived and potent greenhouse gas octafluorooxolane (octafluorotetrahydrofuran, c-C4F8O) in the atmosphere

C6F4O2; tetrafluoro-p-benzoquinone; fluoranil; CAS-No.: 527-21-9; PubChem: CID 68239
P. Brint, P. Tsekeris, A. Bolovinos, C. Kosmidis J. Chem. Soc. Faraday Trans., 2, 85 (3), 177-186, (1989) The vacuum-ultraviolet absorption spectra of substituted p-benzoquinones

J. Pereira-da-Silva, M. Mendes, F. Kossoski, A.I. Lozano, R. Rodrigues, N.C. Jones, S.V. Hoffmann, F. Ferreira da Silva Phys. Chem. Chem. Phys.,23, 2141-2153, (2021) Perfluoro effect on the electronic excited states of para-benzoquinone revealed by experiment and theory

C2H4O; ethylene oxide; oxirane; epoxyethane; CAS-No.: 75-21-8; PubChem: CID 6354
G. Fleming, M.M. Anderson, A.J. Harrison, L.W. Pickett J. Chem. Phys., 30, 351-354, (1959) Effect of Ring Size on the Far Ultraviolet Absorption and Photolysis of Cyclic Ethers

H. Basch, M.B. Robin, N.A. Kuebler J. Chem. Phys., 51, 52-66, (1969) Optical and Photoelectron Spectra of Small Rings. III. The Saturated Three Membered Rings

R. Locht, B. Leyh, H.-W. Jochims, H. Baumgärtel BESSY Jahresbericht/Annual Report 2004, 37-38, (2004) The Vacuum UV Photoabsorption Spectroscopy of the Three membered Ring Systems C3H6, C2H4O and C2H4S and their open Chain Isomers

R. Locht, B. Leyh, H.-W. Jochims, H. Baumgärtel BESSY Jahresbericht/Annual Report 2004, 39-40, (2004) The Photoionization Mass Spectrometric Study of the Three membered Ring Systems C3H6, C2H4O and C2H4S and their open Chain Isomers

C2H4O; vinyl alcohol; ethenol; polyvinyl alcohol; CAS-No.: 9002-89-5; PubChem: CID 11199
D. Rösch, R.L. Caravan, C.A. Taatjes, K. Au, R. Almeida, D.L. Osborn J. Phys. Chem. A, 125, 36, 7920–7928, (2021) Absolute Photoionization Cross Section of the Simplest Enol, Vinyl Alcohol

C3H6O; trimethylene oxide; oxetane; 1,3-propylene oxide; CAS-No.: 503-30-0; PubChem: 24889668
G. Fleming, M.M. Anderson, A.J. Harrison, L.W. Pickett J. Chem. Phys., 30, 351-354, (1959) Effect of Ring Size on the Far Ultraviolet Absorption and Photolysis of Cyclic Ethers

C3H6O; 1-propenol; oxypropylene; propene-1-ol; CAS-No.: 57642-95-2; PubChem: CID 5463330
related data (quantum yield studies; photolysis studies, IR spectral data etc.)
M.F. Shaw, D. Osborn, M.J.T. Jordan, S.H. Kable J. Phys. Chem. A, 121 (19), 3679-3688, (2017) Infrared Spectra of Gas-Phase 1- and 2-Propenol Isomers

C3H6O; 2-propenol; allyl alcohol; 2-propen-1-ol; CAS-No.: 107-18-6; PubChem: CID 7858
B. Yang, J. Wang, T.A. Cool, N. Hansen, S. Skeen, D.L. Osborn Int. J. Mass Spectr., 309, 118-128, (2012) Absolute photoionization cross-sections of some combustion intermediates

related data (quantum yield studies; photolysis studies, IR spectral data etc.)
M.F. Shaw, D. Osborn, M.J.T. Jordan, S.H. Kable J. Phys. Chem. A, 121 (19), 3679-3688, (2017) Infrared Spectra of Gas-Phase 1- and 2-Propenol Isomers

C3H8O2; dimethoxymethane; methylal; CAS-No.: 109-87-5; PubChem: CID 8020
B. Yang, J. Wang, T.A. Cool, N. Hansen, S. Skeen, D.L. Osborn Int. J. Mass Spectr., 309, 118-128, (2012) Absolute photoionization cross-sections of some combustion intermediates

C3H6O3; dimethyl carbonate; methyl carbonate; CAS-No.: 616-38-6; PubChem: CID 12021
A.K. Das, S. Krishnakumar, B.N. Rajasekhar J. Quant. Spectr. Rad. Transfer, 217, 116-125, (2018) Experimental and computational VUV photoabsorption study of dimethyl carbonate: A green solvent

C5H10O3; diethyl carbonate; carbonic acid, diethyl ester; CAS-No.: 105-58-8; PubChem: CID 7766
A.K. Das, B.N. Rajasekhar, S. Krishnakumar J. Quant. Spectr. Rad. Transfer, 217, 53-62, (2018) Spectroscopy of diethyl carbonate, a green solvent: An experimental and theoretical study

C4H6O; 2,3-dihydrofuran; furan, 2,3-dihydro-; CAS-No.: 1191-99-7; PubChem: CID 70934
B. Yang, J. Wang, T.A. Cool, N. Hansen, S. Skeen, D.L. Osborn Int. J. Mass Spectr., 309, 118-128, (2012) Absolute photoionization cross-sections of some combustion intermediates

A. Roeder, N. de Oliveira, F. Grollau, J.-M. Mestdagh, G. Gallician, M.-A. Gaveau, L. Nahon, M. Briant J. Chem. Phys. 153, 134303, (2020) High-resolution vacuum ultraviolet absorption spectra of 2,3- and 2,5-dihydrofuran

A.C. Doner, H.A. Moran, A.R. Webb, M.G. Christanson, A.L. Koritzke, N.S. Dewey, S.W. Hartness, B. Rotavera J. Quant. Spectr. Rad. Transfer, 297, 108438, (2023) Machine learning models for binary molecular classification using VUV absorption spectra

C4H6O; 2,5-dihydrofuran; 3-oxolene; CAS-No.: 1708-29-8; PubChem: CID 15570
B. Yang, J. Wang, T.A. Cool, N. Hansen, S. Skeen, D.L. Osborn Int. J. Mass Spectr., 309, 118-128, (2012) Absolute photoionization cross-sections of some combustion intermediates

A. Roeder, N. de Oliveira, F. Grollau, J.-M. Mestdagh, G. Gallician, M.-A. Gaveau, L. Nahon, M. Briant J. Chem. Phys. 153, 134303, (2020) High-resolution vacuum ultraviolet absorption spectra of 2,3- and 2,5-dihydrofuran

A.C. Doner, H.A. Moran, A.R. Webb, M.G. Christanson, A.L. Koritzke, N.S. Dewey, S.W. Hartness, B. Rotavera J. Quant. Spectr. Rad. Transfer, 297, 108438, (2023) Machine learning models for binary molecular classification using VUV absorption spectra

C4H6O; 2-vinyloxirane; 3,4-epoxy-1-butene; 2-ethenyloxiran; CAS-No.: 930-22-3; PubChem:
M.G. Christianson, A.C. Doner, M.M. Davis, A.L. Koritzke, J.M. Turney, H.F. Schaefer III, L. Sheps, D.L. Osborn, C.A. Taatjes, B. Rotavera Int. J. Chem. Kin., 53 (1), 43-59, (2021) Reaction mechanisms of a cyclic ether intermediate: Ethyloxirane

A.C. Doner, A.R. Webb, N.S. Dewey, S.W. Hartness, M.G. Christianson, A.L. Koritzke, A. Larsson, K.M. Frandsen, B. Rotavera J. Quant. Spectr. Rad. Transfer, 292, 108346, (2022) Vacuum-ultraviolet absorption cross-sections of functionalized four-carbon species

A.C. Doner, H.A. Moran, A.R. Webb, M.G. Christanson, A.L. Koritzke, N.S. Dewey, S.W. Hartness, B. Rotavera J. Quant. Spectr. Rad. Transfer, 297, 108438, (2023) Machine learning models for binary molecular classification using VUV absorption spectra

C4H8O; 3-buten-1-ol; allylcarbinol; CAS-No.: 627-27-0; PubChem: CID 69389
A.C. Doner, A.R. Webb, N.S. Dewey, S.W. Hartness, M.G. Christianson, A.L. Koritzke, A. Larsson, K.M. Frandsen, B. Rotavera J. Quant. Spectr. Rad. Transfer, 292, 108346, (2022) Vacuum-ultraviolet absorption cross-sections of functionalized four-carbon species

A.C. Doner, H.A. Moran, A.R. Webb, M.G. Christanson, A.L. Koritzke, N.S. Dewey, S.W. Hartness, B. Rotavera J. Quant. Spectr. Rad. Transfer, 297, 108438, (2023) Machine learning models for binary molecular classification using VUV absorption spectra

C4H8O; 2,3-butyleneoxide; 2,3-epoxybutane; 2,3-dimethyloxirane; CAS-No.: 3266-23-7; PubChem: CID 18632
A.C. Doner, H.A. Moran, A.R. Webb, M.G. Christanson, A.L. Koritzke, N.S. Dewey, S.W. Hartness, B. Rotavera J. Quant. Spectr. Rad. Transfer, 297, 108438, (2023) Machine learning models for binary molecular classification using VUV absorption spectra

C4H8O; cis-2-buten-1-ol; 2-buten-1-ol; CAS-No.: 4088-60-2; PubChem: CID 643789
A.C. Doner, A.R. Webb, N.S. Dewey, S.W. Hartness, M.G. Christianson, A.L. Koritzke, A. Larsson, K.M. Frandsen, B. Rotavera J. Quant. Spectr. Rad. Transfer, 292, 108346, (2022) Vacuum-ultraviolet absorption cross-sections of functionalized four-carbon species

C4H8O; trans-2,3-dimethyloxirane; trans-2,3-epoxybutane; CAS-No.: 1758-32-3; PubChem: CID 6432237
A.C. Doner, A.R. Webb, N.S. Dewey, S.W. Hartness, M.G. Christianson, A.L. Koritzke, A. Larsson, K.M. Frandsen, B. Rotavera J. Quant. Spectr. Rad. Transfer, 292, 108346, (2022) Vacuum-ultraviolet absorption cross-sections of functionalized four-carbon species

A.C. Doner, H.A. Moran, A.R. Webb, M.G. Christanson, A.L. Koritzke, N.S. Dewey, S.W. Hartness, B. Rotavera J. Quant. Spectr. Rad. Transfer, 297, 108438, (2023) Machine learning models for binary molecular classification using VUV absorption spectra

C4H8O; cis-2,3-dimethyloxirane; cis-2,3-epoxybutane; cis-2-buteneoxide; CAS-No.: 1758-33-4; PubChem: CID 92162
A.C. Doner, A.R. Webb, N.S. Dewey, S.W. Hartness, M.G. Christianson, A.L. Koritzke, A. Larsson, K.M. Frandsen, B. Rotavera J. Quant. Spectr. Rad. Transfer, 292, 108346, (2022) Vacuum-ultraviolet absorption cross-sections of functionalized four-carbon species

A.C. Doner, H.A. Moran, A.R. Webb, M.G. Christanson, A.L. Koritzke, N.S. Dewey, S.W. Hartness, B. Rotavera J. Quant. Spectr. Rad. Transfer, 297, 108438, (2023) Machine learning models for binary molecular classification using VUV absorption spectra

C4H8O; ethyloxirane; 1,2-epoxybutane; CAS-No.: 106-88-7; PubChem: CID 7834
A.C. Doner, A.R. Webb, N.S. Dewey, S.W. Hartness, M.G. Christianson, A.L. Koritzke, A. Larsson, K.M. Frandsen, B. Rotavera J. Quant. Spectr. Rad. Transfer, 292, 108346, (2022) Vacuum-ultraviolet absorption cross-sections of functionalized four-carbon species

A.C. Doner, H.A. Moran, A.R. Webb, M.G. Christanson, A.L. Koritzke, N.S. Dewey, S.W. Hartness, B. Rotavera J. Quant. Spectr. Rad. Transfer, 297, 108438, (2023) Machine learning models for binary molecular classification using VUV absorption spectra

C4H8O; 2-methyloxetane; 1,3-epoxybutane; CAS-No.: 2167-39-7; PubChem: CID 16565
A.C. Doner, A.R. Webb, N.S. Dewey, S.W. Hartness, M.G. Christianson, A.L. Koritzke, A. Larsson, K.M. Frandsen, B. Rotavera J. Quant. Spectr. Rad. Transfer, 292, 108346, (2022) Vacuum-ultraviolet absorption cross-sections of functionalized four-carbon species

A.C. Doner, H.A. Moran, A.R. Webb, M.G. Christanson, A.L. Koritzke, N.S. Dewey, S.W. Hartness, B. Rotavera J. Quant. Spectr. Rad. Transfer, 297, 108438, (2023) Machine learning models for binary molecular classification using VUV absorption spectra

C4H6O2; 1,4-dioxene; 2,3-dihydro-1,4-dioxine; CAS-No.: 543-75-9; PubChem: CID 136353
A.C. Doner, M.G. Christianson, J.C. Davis, A.L. Koritzke, A. Larsson, K. Frandsen, B. Rotavera J. Quant. Spectr. Rad. Transfer, 236, 106603, (2019) Vacuum-ultraviolet absorption cross-sections of functionalized cyclic hydrocarbons: Six-membered rings

A.C. Doner, H.A. Moran, A.R. Webb, M.G. Christanson, A.L. Koritzke, N.S. Dewey, S.W. Hartness, B. Rotavera J. Quant. Spectr. Rad. Transfer, 297, 108438, (2023) Machine learning models for binary molecular classification using VUV absorption spectra

C4H6O2; tetrahydrofuran-3-one; oxolan-3-one; CAS-No.: 22929-52-8; PubChem: CID 529392
M.G. Christianson, A.C. Doner, A.L. Koritzke, K. Frandsen, B. Rotavera J. Quant. Spectr. Rad. Transfer, 258, 107274, (2021) Vacuum-Ultraviolet Absorption Cross-Sections of Functionalized Cyclic Hydrocarbons: Five-Membered Rings

A.C. Doner, H.A. Moran, A.R. Webb, M.G. Christanson, A.L. Koritzke, N.S. Dewey, S.W. Hartness, B. Rotavera J. Quant. Spectr. Rad. Transfer, 297, 108438, (2023) Machine learning models for binary molecular classification using VUV absorption spectra

C4H6O2; 2,2'-bioxirane; diepoxybutane; 1,3-butadiene diepoxide; CAS-No.: 1464-53-5; PubChem: CID 11254
M.G. Christianson, A.C. Doner, M.M. Davis, A.L. Koritzke, J.M. Turney, H.F. Schaefer III, L. Sheps, D.L. Osborn, C.A. Taatjes, B. Rotavera Int. J. Chem. Kin., 53 (1), 43-59, (2021) Reaction mechanisms of a cyclic ether intermediate: Ethyloxirane

A.C. Doner, A.R. Webb, N.S. Dewey, S.W. Hartness, M.G. Christianson, A.L. Koritzke, A. Larsson, K.M. Frandsen, B. Rotavera J. Quant. Spectr. Rad. Transfer, 292, 108346, (2022) Vacuum-ultraviolet absorption cross-sections of functionalized four-carbon species

A.C. Doner, H.A. Moran, A.R. Webb, M.G. Christanson, A.L. Koritzke, N.S. Dewey, S.W. Hartness, B. Rotavera J. Quant. Spectr. Rad. Transfer, 297, 108438, (2023) Machine learning models for binary molecular classification using VUV absorption spectra

C4H6O2; 4H-1,3-dioxin; 1,3-dioxin; CAS-No.: 290-13-1; PubChem: CID 10942338
A.C. Doner, A.R. Webb, N.S. Dewey, S.W. Hartness, M.G. Christianson, A.L. Koritzke, A. Larsson, K.M. Frandsen, B. Rotavera J. Quant. Spectr. Rad. Transfer, 292, 108346, (2022) Vacuum-ultraviolet absorption cross-sections of functionalized four-carbon species

C4H6O2; 2-methyloxetan-3-one; 2-methyl-oxetan-3-one; CAS-No.: 87385-83-9; PubChem: CID 13111185
A.C. Doner, A.R. Webb, N.S. Dewey, S.W. Hartness, M.G. Christianson, A.L. Koritzke, A. Larsson, K.M. Frandsen, B. Rotavera J. Quant. Spectr. Rad. Transfer, 292, 108346, (2022) Vacuum-ultraviolet absorption cross-sections of functionalized four-carbon species

C4H6O2; 3,4-epoxybutanone; 2-acetyloxirane; 1-oxiranylethanone; CAS-No.: 4401-11-0; PubChem: CID 521300
A.C. Doner, A.R. Webb, N.S. Dewey, S.W. Hartness, M.G. Christianson, A.L. Koritzke, A. Larsson, K.M. Frandsen, B. Rotavera J. Quant. Spectr. Rad. Transfer, 292, 108346, (2022) Vacuum-ultraviolet absorption cross-sections of functionalized four-carbon species

A.C. Doner, H.A. Moran, A.R. Webb, M.G. Christanson, A.L. Koritzke, N.S. Dewey, S.W. Hartness, B. Rotavera J. Quant. Spectr. Rad. Transfer, 297, 108438, (2023) Machine learning models for binary molecular classification using VUV absorption spectra

C4H8O2; 1,4-dioxane; 1,4-dioxacyclohexane; CAS-No.: 123-91-1; PubChem: CID 31275
L.J. Bremner, M.G. Curtis, I.C. Walker J. Chem. Soc., Faraday Trans.,87, 1049-1055, (1991) Electronic States of Some Simple Ethers Studied by Vacuum Ultraviolet Absorption and Near-threshold Electron Energy-loss Spectroscopy

A.C. Doner, M.G. Christianson, J.C. Davis, A.L. Koritzke, A. Larsson, K. Frandsen, B. Rotavera J. Quant. Spectr. Rad. Transfer, 236, 106603, (2019) Vacuum-ultraviolet absorption cross-sections of functionalized cyclic hydrocarbons: Six-membered rings

A.C. Doner, H.A. Moran, A.R. Webb, M.G. Christanson, A.L. Koritzke, N.S. Dewey, S.W. Hartness, B. Rotavera J. Quant. Spectr. Rad. Transfer, 297, 108438, (2023) Machine learning models for binary molecular classification using VUV absorption spectra

C4H8O2; 2,3-epoxybutanol; 3-methyloxiranemethanol; (3-methyl-2-oxiranyl)methanol; CAS-No.: 872-38-8; PubChem: CID
A.C. Doner, H.A. Moran, A.R. Webb, M.G. Christanson, A.L. Koritzke, N.S. Dewey, S.W. Hartness, B. Rotavera J. Quant. Spectr. Rad. Transfer, 297, 108438, (2023) Machine learning models for binary molecular classification using VUV absorption spectra

C4H8O2; (2-methyloxiran-2-yl)methanol; 2-methyl-2,3-epoxy-1-propanol; CAS-No.: 872-30-0; PubChem: CID 97754
A.C. Doner, H.A. Moran, A.R. Webb, M.G. Christanson, A.L. Koritzke, N.S. Dewey, S.W. Hartness, B. Rotavera J. Quant. Spectr. Rad. Transfer, 297, 108438, (2023) Machine learning models for binary molecular classification using VUV absorption spectra

C4H8O2; 2-hydroxytetrahydrofuran; tetrahydrofuran-2-ol; CAS-No.: 5371-52-8; PubChem: CID 93002
M.G. Christianson, A.C. Doner, A.L. Koritzke, K. Frandsen, B. Rotavera J. Quant. Spectr. Rad. Transfer, 258, 107274, (2021) Vacuum-Ultraviolet Absorption Cross-Sections of Functionalized Cyclic Hydrocarbons: Five-Membered Rings

A.C. Doner, H.A. Moran, A.R. Webb, M.G. Christanson, A.L. Koritzke, N.S. Dewey, S.W. Hartness, B. Rotavera J. Quant. Spectr. Rad. Transfer, 297, 108438, (2023) Machine learning models for binary molecular classification using VUV absorption spectra

C4H8O2; 2-methyl-1,3-dioxolane; 1,3-dioxolane, 2-methyl-; CAS-No.: 497-26-7; PubChem: CID 10342
M.G. Christianson, A.C. Doner, A.L. Koritzke, K. Frandsen, B. Rotavera J. Quant. Spectr. Rad. Transfer, 258, 107274, (2021) Vacuum-Ultraviolet Absorption Cross-Sections of Functionalized Cyclic Hydrocarbons: Five-Membered Rings

A.C. Doner, H.A. Moran, A.R. Webb, M.G. Christanson, A.L. Koritzke, N.S. Dewey, S.W. Hartness, B. Rotavera J. Quant. Spectr. Rad. Transfer, 297, 108438, (2023) Machine learning models for binary molecular classification using VUV absorption spectra

C4H8O2; 1-hydroxybutan-2-one; 1-hydroxy-2-butanone; CAS-No.: 5077-67-8; PubChem: CID 521300
A.C. Doner, A.R. Webb, N.S. Dewey, S.W. Hartness, M.G. Christianson, A.L. Koritzke, A. Larsson, K.M. Frandsen, B. Rotavera J. Quant. Spectr. Rad. Transfer, 292, 108346, (2022) Vacuum-ultraviolet absorption cross-sections of functionalized four-carbon species

A.C. Doner, H.A. Moran, A.R. Webb, M.G. Christanson, A.L. Koritzke, N.S. Dewey, S.W. Hartness, B. Rotavera J. Quant. Spectr. Rad. Transfer, 297, 108438, (2023) Machine learning models for binary molecular classification using VUV absorption spectra

C4H8O2; 2,3-epoxybutan-1-ol; trans-2,3-epoxybutanol; CAS-No.: 55058-23-6; PubChem: CID
A.C. Doner, A.R. Webb, N.S. Dewey, S.W. Hartness, M.G. Christianson, A.L. Koritzke, A. Larsson, K.M. Frandsen, B. Rotavera J. Quant. Spectr. Rad. Transfer, 292, 108346, (2022) Vacuum-ultraviolet absorption cross-sections of functionalized four-carbon species

C4H8O2; 3,4-epoxybutan-1-ol; 3,4-epoxybutanol; CAS-No.: 19098-31-8; PubChem: CID
A.C. Doner, A.R. Webb, N.S. Dewey, S.W. Hartness, M.G. Christianson, A.L. Koritzke, A. Larsson, K.M. Frandsen, B. Rotavera J. Quant. Spectr. Rad. Transfer, 292, 108346, (2022) Vacuum-ultraviolet absorption cross-sections of functionalized four-carbon species

A.C. Doner, H.A. Moran, A.R. Webb, M.G. Christanson, A.L. Koritzke, N.S. Dewey, S.W. Hartness, B. Rotavera J. Quant. Spectr. Rad. Transfer, 297, 108438, (2023) Machine learning models for binary molecular classification using VUV absorption spectra

C4H8O2; 2-oxetanemethanol; oxetan-2-ylmethanol; 2-hydroxymethyloxetane; CAS-No.: 61266-70-4; PubChem: CID 12284142
A.C. Doner, A.R. Webb, N.S. Dewey, S.W. Hartness, M.G. Christianson, A.L. Koritzke, A. Larsson, K.M. Frandsen, B. Rotavera J. Quant. Spectr. Rad. Transfer, 292, 108346, (2022) Vacuum-ultraviolet absorption cross-sections of functionalized four-carbon species

A.C. Doner, H.A. Moran, A.R. Webb, M.G. Christanson, A.L. Koritzke, N.S. Dewey, S.W. Hartness, B. Rotavera J. Quant. Spectr. Rad. Transfer, 297, 108438, (2023) Machine learning models for binary molecular classification using VUV absorption spectra

C5H4O2; protoanemonin; 5-methylidenefuran-2-one; CAS-No.: 108-28-1; PubChem: CID 66984
E. Shaw J. Am. Chem. Soc., 68 (12), 2510-2513, (1946) A synthesis of protoanemonin. The tautomerism of acetylacrylic acid and of penicillic acid

C5H4O2; 4-pyrone; 4H-pyran-4-one; gamma-pyrone CAS-No.: 108-97-4
N. Ishibe, H. Sugimoto, J.B. Gallivan J. Chem. Soc., Faraday Trans. 2,71, 1812-1822, (1975) Electronic absorption and emission spectra of 4-pyrones, 4-thiopyrones and 4-pyridones

R.D. Gordon, W.K.C. Park Can. J. Chem., 71 (10), 1672-1675, (1993) The 353 nm n pi* transition of 4H-pyran-4-one and deuterated derivative

M.H. Palmer, S V. Hoffmann, N.C. Jones, M. Coreno, M. de Simone, C. Grazioli, R.A. Aitken, L. Perrault, I.L.J. Patterson J. Chem. Phys., 160, 054305 (2024) The ultraviolet and vacuum ultraviolet absorption spectrum of gamma-pyrone; the singlet states studied by configuration interaction and density functional calculations

C6H4O2; 1,4-benzoquinone; p-benzoquinone; p-quinone; cyclohexa-2,5-diene-1,4-dione; CAS-No.: 106-51-4; PubChem: 4650
A. Kuboyama Bull. Chem. Soc. Japan, 33 (8), 1027-1030, (1960) The n - pi* transition band of acenaphthenequinone

A. Kuboyama, R. Yamazaki, S. Sanae, Y. Uehara Bull. Chem. Soc. Japan, 42 (1), 10-15, (1969) The n -> pi* Bands of Phenyl Carbonyl Compounds, alpha-Diketones, and Quinones at Low Temperatures

P. Brint, J.-P. Connerade, P. Tsekeris, A. Bolovinos, A. Baig J. Chem. Soc., Faraday Trans. 2, 82, 367-375, (1986) Vacuum ultraviolet absorption spectrum of p-Benzoquinone

P. Brint, P. Tsekeris, A. Bolovinos, C. Kosmidis J. Chem. Soc. Faraday Trans., 2, 85 (3), 177-186, (1989) The vacuum-ultraviolet absorption spectra of substituted p-benzoquinones

D.B. Jones, P. Limão-Vieira, M. Mendes, N.C. Jones, S.V. Hoffmann, R.F. da Costa, M.T. do N. Varella, M.H.F. Bettega, F. Blanco, G. García, O. Ingólfsson, M.A.P. Lima, M.J. Brunger J. Chem. Phys., 146, 184303, (2017) An experimental and theoretical investigation into the electronically excited states of para-benzoquinone

J. Xu, C.-H. Huang Environ. Sci. Technol. Lett., 10, 6, 543-548, (2023) Enhanced Direct Photolysis of Organic Micropollutants by Far-UVC Light at 222 nm from KrCl* Excilamps

C5H8O; 3,4-dihydropyran; 3,4-dihydro-2H-pyran; CAS-No.: 110-87-2; PubChem: CID 8080
A.A. Planckaert, J. Doucet, C. Sandorfy J. Chem. Phys., 60, 4846, (1974) Comparative study of the vacuum ultraviolet absorption and photoelectron spectra of some simple ethers and thioethers

L.J. Bremner, M.G. Curtis, I.C. Walker J. Chem. Soc., Faraday Trans.,87, 1049-1055, (1991) Electronic States of Some Simple Ethers Studied by Vacuum Ultraviolet Absorption and Near-threshold Electron Energy-loss Spectroscopy

A.C. Doner, M.G. Christianson, J.C. Davis, A.L. Koritzke, A. Larsson, K. Frandsen, B. Rotavera J. Quant. Spectr. Rad. Transfer, 236, 106603, (2019) Vacuum-ultraviolet absorption cross-sections of functionalized cyclic hydrocarbons: Six-membered rings

J.C. Davis, A.L. Koritzke, R.L. Caravan, I.O. Antonov, M.G. Christianson, A.C. Doner, D.L. Osborn, L.Sheps, C.A. Taatjes, B. Rotavera J. Phys. Chem. A, 123, 17, 3634–3646, (2019) Influence of Ether Functional Group on Ketohydroperoxide Formation in Cyclic Hydrocarbons: Tetrahydropyran and Cyclohexane

A.C. Doner, H.A. Moran, A.R. Webb, M.G. Christanson, A.L. Koritzke, N.S. Dewey, S.W. Hartness, B. Rotavera J. Quant. Spectr. Rad. Transfer, 297, 108438, (2023) Machine learning models for binary molecular classification using VUV absorption spectra

C5H8O; 3,6-dihydropyran; CAS-No.: 3174-74-1; PubChem: CID 520540
J.C. Davis, A.L. Koritzke, R.L. Caravan, I.O. Antonov, M.G. Christianson, A.C. Doner, D.L. Osborn, L.Sheps, C.A. Taatjes, B. Rotavera J. Phys. Chem. A, 123, 17, 3634–3646, (2019) Influence of Ether Functional Group on Ketohydroperoxide Formation in Cyclic Hydrocarbons: Tetrahydropyran and Cyclohexane

C5H8O; cyclopentene oxide; 1,2-epoxycyclopentane; CAS-No.: 285-67-6; PubChem: CID 9244
M.G. Christianson, A.C. Doner, A.L. Koritzke, K. Frandsen, B. Rotavera J. Quant. Spectr. Rad. Transfer, 258, 107274, (2021) Vacuum-Ultraviolet Absorption Cross-Sections of Functionalized Cyclic Hydrocarbons: Five-Membered Rings

A.C. Doner, H.A. Moran, A.R. Webb, M.G. Christanson, A.L. Koritzke, N.S. Dewey, S.W. Hartness, B. Rotavera J. Quant. Spectr. Rad. Transfer, 297, 108438, (2023) Machine learning models for binary molecular classification using VUV absorption spectra

C5H8O; 5-methyl-2,3-dihydrofuran; 2,3-dihydro-5-methylfuran; CAS-No.: 1487-15-6; PubChem: CID 15145
M.G. Christianson, A.C. Doner, A.L. Koritzke, K. Frandsen, B. Rotavera J. Quant. Spectr. Rad. Transfer, 258, 107274, (2021) Vacuum-Ultraviolet Absorption Cross-Sections of Functionalized Cyclic Hydrocarbons: Five-Membered Rings

A.C. Doner, H.A. Moran, A.R. Webb, M.G. Christanson, A.L. Koritzke, N.S. Dewey, S.W. Hartness, B. Rotavera J. Quant. Spectr. Rad. Transfer, 297, 108438, (2023) Machine learning models for binary molecular classification using VUV absorption spectra

C5H10O; allyl ethyl ether; 1-propene, 3-ethoxy-; 3-ethoxyprop-1-ene; CAS-No.: 557-31-3; PubChem: CID 11191
M. Antiñolo, A.J. Ocaña, J.P. Aranguren, S.I. Lane, J. Albaladejo, E. Jiménez Chemosphere, 181, 232-240, (2017) Atmospheric degradation of 2-chloroethyl vinyl ether, allyl ether and allyl ethyl ether: Kinetics with OH radicals and UV photochemistry

C6H8O; 3,4-epoxycyclohexene; cyclohexa-1,3-diene oxide; CAS-No.: 6705-51-7; PubChem: CID 11094544
A.C. Doner, M.G. Christianson, J.C. Davis, A.L. Koritzke, A. Larsson, K. Frandsen, B. Rotavera J. Quant. Spectr. Rad. Transfer, 236, 106603, (2019) Vacuum-ultraviolet absorption cross-sections of functionalized cyclic hydrocarbons: Six-membered rings

A.C. Doner, H.A. Moran, A.R. Webb, M.G. Christanson, A.L. Koritzke, N.S. Dewey, S.W. Hartness, B. Rotavera J. Quant. Spectr. Rad. Transfer, 297, 108438, (2023) Machine learning models for binary molecular classification using VUV absorption spectra

C6H8O; 4,5-epoxycyclohexene; cyclohexa-4,5-diene oxide; CAS-No.: 6253-27-6; PubChem:
A.C. Doner, M.G. Christianson, J.C. Davis, A.L. Koritzke, A. Larsson, K. Frandsen, B. Rotavera J. Quant. Spectr. Rad. Transfer, 236, 106603, (2019) Vacuum-ultraviolet absorption cross-sections of functionalized cyclic hydrocarbons: Six-membered rings

A.C. Doner, H.A. Moran, A.R. Webb, M.G. Christanson, A.L. Koritzke, N.S. Dewey, S.W. Hartness, B. Rotavera J. Quant. Spectr. Rad. Transfer, 297, 108438, (2023) Machine learning models for binary molecular classification using VUV absorption spectra

C6H10O; allyl ether; 3-(allyloxy)-1-propene; CAS-No.: 557-40-4
M. Antiñolo, A.J. Ocaña, J.P. Aranguren, S.I. Lane, J. Albaladejo, E. Jiménez Chemosphere, 181, 232-240, (2017) Atmospheric degradation of 2-chloroethyl vinyl ether, allyl ether and allyl ethyl ether: Kinetics with OH radicals and UV photochemistry

C6H10O; 1,5-hexadien-3-ol; 3-hydroxy-1,5-hexadiene; CAS-No.: 924-41-4; PubChem: CID 79122
A.C. Doner, H.A. Moran, A.R. Webb, M.G. Christanson, A.L. Koritzke, N.S. Dewey, S.W. Hartness, B. Rotavera J. Quant. Spectr. Rad. Transfer, 297, 108438, (2023) Machine learning models for binary molecular classification using VUV absorption spectra

C6H10O; 2-cyclohexen-1-ol; cyclohex-2-enol; cyclohexen-3-ol; CAS-No.: 822-67-3; PubChem: CID 13198
A.C. Doner, M.G. Christianson, J.C. Davis, A.L. Koritzke, A. Larsson, K. Frandsen, B. Rotavera J. Quant. Spectr. Rad. Transfer, 236, 106603, (2019) Vacuum-ultraviolet absorption cross-sections of functionalized cyclic hydrocarbons: Six-membered rings

A.C. Doner, H.A. Moran, A.R. Webb, M.G. Christanson, A.L. Koritzke, N.S. Dewey, S.W. Hartness, B. Rotavera J. Quant. Spectr. Rad. Transfer, 297, 108438, (2023) Machine learning models for binary molecular classification using VUV absorption spectra

C6H10O; cyclohexen-4-ol; 3-cyclohexen-1-ol; CAS-No.: 822-66-2; PubChem:
A.C. Doner, M.G. Christianson, J.C. Davis, A.L. Koritzke, A. Larsson, K. Frandsen, B. Rotavera J. Quant. Spectr. Rad. Transfer, 236, 106603, (2019) Vacuum-ultraviolet absorption cross-sections of functionalized cyclic hydrocarbons: Six-membered rings

A.C. Doner, H.A. Moran, A.R. Webb, M.G. Christanson, A.L. Koritzke, N.S. Dewey, S.W. Hartness, B. Rotavera J. Quant. Spectr. Rad. Transfer, 297, 108438, (2023) Machine learning models for binary molecular classification using VUV absorption spectra

C6H10O; 2-methylcyclopentan-1-one; 2-methylcyclopentanone; CAS-No.: 1120-72-5; PubChem: CID 14265
M.G. Christianson, A.C. Doner, A.L. Koritzke, K. Frandsen, B. Rotavera J. Quant. Spectr. Rad. Transfer, 258, 107274, (2021) Vacuum-Ultraviolet Absorption Cross-Sections of Functionalized Cyclic Hydrocarbons: Five-Membered Rings

A.C. Doner, H.A. Moran, A.R. Webb, M.G. Christanson, A.L. Koritzke, N.S. Dewey, S.W. Hartness, B. Rotavera J. Quant. Spectr. Rad. Transfer, 297, 108438, (2023) Machine learning models for binary molecular classification using VUV absorption spectra

C6H12O; cyclohexanol; cyclohexyl alcohol; CAS-No.: 108-93-0; PubChem: CID 7966
A.C. Doner, M.G. Christianson, J.C. Davis, A.L. Koritzke, A. Larsson, K. Frandsen, B. Rotavera J. Quant. Spectr. Rad. Transfer, 236, 106603, (2019) Vacuum-ultraviolet absorption cross-sections of functionalized cyclic hydrocarbons: Six-membered rings

A.C. Doner, H.A. Moran, A.R. Webb, M.G. Christanson, A.L. Koritzke, N.S. Dewey, S.W. Hartness, B. Rotavera J. Quant. Spectr. Rad. Transfer, 297, 108438, (2023) Machine learning models for binary molecular classification using VUV absorption spectra

C6H14O; 1-hexanol; hexyl alcohol; CAS-No.: 111-27-3; PubChem: CID 8103
L. Lagesson-Andrasko, V. Lagesson, J. Andrasko Anal. Chem., 70 (5), 819-826, (1998) The use of gas-phase UV spectra in the 168-330 nm wavelength region for analytical purposes. 1. Qualitative measurements

C7H6O; tropone; 2,4,6-cycloheptatrien-1-one; cyclohepta-2,4,6-trien-1-one; CAS-No.: 539-80-0; PubChem: CID 10881
H. Hosoya, J. Tanaka, S. Nagakura Tetrahedron, 18, 859-874, (1962) Ultra-violet absorption spectra of tropone, troponium ion, tropolone and 2,4,6-octatrienal

C8H6O; benzofuran; coumarone; CAS-No.: 271-89-6; PubChem: CID 9223
I. Nobuko, T. Akio, H. Masahiro Bull. Chem. Soc. Japan, 54 (5), 1511-1516, (1981) The magnetic circular dichroism of the conjugated O- and S-heterocycles

C11H10O; 1-naphthylcarbinol; 1-naphthalenemethanol; 1-(hydroxymethyl)naphthalene; CAS-No.: 4780-79-4
T. Fujita, K. Koshimizu, T. Mitsui Tetrahedron, 22, 1587-1596, (1966) Ultraviolet absorption spectra of substituted 1-naphthoic acids

C7H6O2; methyl-p-benzoquinone; p-toluquinone; CAS-No.: 553-97-9; PubChem: 11122
P. Brint, P. Tsekeris, A. Bolovinos, C. Kosmidis J. Chem. Soc. Faraday Trans., 2, 85 (3), 177-186, (1989) The vacuum-ultraviolet absorption spectra of substituted p-benzoquinones

C. Anastasio, B.C. Faust, C.J. Rao Environ. Sci. Technol., 31, 1, 218–232, (1996) Aromatic Carbonyl Compounds as Aqueous-Phase Photochemical Sources of Hydrogen Peroxide in Acidic Sulfate Aerosols, Fogs, and Clouds. 1. Non-Phenolic Methoxybenzaldehydes and Methoxyacetophenones with Reductants (Phenols)

C7H6O2; tropolone; 2-hydroxytropone; CAS-No.: 533-75-5; PubChem: CID 10789
H. Hosoya, J. Tanaka, S. Nagakura Tetrahedron, 18, 859-874, (1962) Ultra-violet absorption spectra of tropone, troponium ion, tropolone and 2,4,6-octatrienal

C8H8O2; 2,5-dimethyl-p-benzoquinone; 2,5-dimethyl-p-benzochinon; p-xycloquinone; CAS-No.: 137-18-8
P. Brint, P. Tsekeris, A. Bolovinos, C. Kosmidis J. Chem. Soc. Faraday Trans., 2, 85 (3), 177-186, (1989) The vacuum-ultraviolet absorption spectra of substituted p-benzoquinones

C8H8O2; 2,6-dimethyl-p-benzoquinone; 2,6-dimethylbenzoquinone; CAS-No.: 527-61-7; PubChem: 68241
P. Brint, P. Tsekeris, A. Bolovinos, C. Kosmidis J. Chem. Soc. Faraday Trans., 2, 85 (3), 177-186, (1989) The vacuum-ultraviolet absorption spectra of substituted p-benzoquinones

C8H8O2; 1,4-benzodioxane; 2,3-dihydro-1,4-benzodioxine; CAS-No.: 493-09-4; PubChem: CID 10301
B. Vidal Chem. Papers, 57 (2), 112-118, (2003) Near UV Spectroscopy and Electronic Structure of Dibenzo-p-dioxin, the Parent Compound of Highly Food-Polluting Agents

C8H10O; 2,4,6-octatrienal; octa-2,4,6-trienal; CAS-No.: 17609-31-3; PubChem: CID 5283331
H. Hosoya, J. Tanaka, S. Nagakura Tetrahedron, 18, 859-874, (1962) Ultra-violet absorption spectra of tropone, troponium ion, tropolone and 2,4,6-octatrienal

C8H10O; 4-methylbenzyl alcohol; p-methylbenzyl alcohol; p-tolylmethanol; CAS-No.: 589-18-4; PubChem: CID 11505
R.F. Rekker, W.T. Nauta Recueil Travaux Chimiques Pays-Bas, 87 (10), 1099-1109, (1968) The UV absorption of substituted benzhydrols and of the corresponding 2-(dimethylamino)ethyl ethers

C9H10O; 1-methyl-1,3-dihydro-isobenzofuran; 1-methyl-1,3-dihydro-2-benzofuran; CAS-No.: 38189-85-4; PubChem: CID 14664731
A.C. Doner, H.A. Moran, A.R. Webb, M.G. Christanson, A.L. Koritzke, N.S. Dewey, S.W. Hartness, B. Rotavera J. Quant. Spectr. Rad. Transfer, 297, 108438, (2023) Machine learning models for binary molecular classification using VUV absorption spectra

C9H12O; phenyldimethylcarbinol; 2-phenylpropan-2-ol; alpha-cumyl alcohol; CAS-No.: 617-94-7
N.A. Shimanko, E.A. Robinzon, T.K. Efimova J. Applied Spectroscopy, 8 (5), 533-534, (1968) Electronic absorption spectra of some aromatic oxygen compounds

C9H12O; 2,6-dimethylanisole; 2-methoxy-1,3-dimethylbenzene; 2-methoxy-m-xylene; CAS-No.: 1004-66-6; PubChem: CID 66088
E.R. Clark, S.G. Wilson J. Chem. Soc. B, 0, 859-866, (1967) The conformations of aromatic ethers as determined from their ultraviolet absorption spectra

C10H12O; 8-methylchroman; 3,4-dihydro-8-methyl-2H-1-benzopyran; CAS-No.: 3722-72-3
E.R. Clark, S.G. Wilson J. Chem. Soc. B, 0, 859-866, (1967) The conformations of aromatic ethers as determined from their ultraviolet absorption spectra

C10H12O; isobutyrophenone; isopropyl phenyl ketone ; isobutyrylbenzene; CAS-No.: 611-70-1; PubChem: CID 69144
A. Kuboyama, R. Yamazaki, S. Sanae, Y. Uehara Bull. Chem. Soc. Japan, 42 (1), 10-15, (1969) The n -> pi* Bands of Phenyl Carbonyl Compounds, alpha-Diketones, and Quinones at Low Temperatures

C10H18O; linalool; 3,7-dimethylocta-1,6-dien-3-ol; (R)-(−)-linalool; CAS-No.: 126-91-0; PubChem:
A.M.J.C. Neto, G.V.S. Mota, R.S. Borges, M.L.S. Albuquerque J. Comp. Theor. Nanoscience, 7, 1-4, (2010) R-(-)Linalool UV Spectroscopy: The Experimental and Theoretical Study

C10H12O2; tetramethyl-p-benzoquinone; 2,3,5,6-tetramethyl-1,4-benzoquinone; duroquinone; CAS-No.: 527-17-3
P. Brint, P. Tsekeris, A. Bolovinos, C. Kosmidis J. Chem. Soc. Faraday Trans., 2, 85 (3), 177-186, (1989) The vacuum-ultraviolet absorption spectra of substituted p-benzoquinones

C10H12O2; eugenol; 4-allyl-2-methoxyphenol; CAS-No.: 97-53-0; PubChem: CID 3314
V.C. Vespe, D.F. Boltz Anal. Chem., 24 (4), 664-666, (1952) Ultraviolet spectrophotometric study of eugenol-isoeugenol system

R. Ayoubi, S. Wali, G.B. Singh Int. J. Innovative Research and Scientific Studies, 5(1), 1-9, (2022) The UV and FTIR Fingerprint of Ocimum kilimandscharicum Guerke Essential oil: A Eugenol-Rich Chemo Typ

C10H12O2; iso-eugenol; 2-methoxy-4-propenylphenol; 4-propenylguaiacol; CAS-No.: 97-54-1; PubChem: CID 7338
V.C. Vespe, D.F. Boltz Anal. Chem., 24 (4), 664-666, (1952) Ultraviolet spectrophotometric study of eugenol-isoeugenol system

C10H14O2; camphorquinone; 2,3-bornanedione; CAS-No.: 10373-78-1; PubChem: CID 25208
A. Kuboyama, R. Yamazaki, S. Sanae, Y. Uehara Bull. Chem. Soc. Japan, 42 (1), 10-15, (1969) The n -> pi* Bands of Phenyl Carbonyl Compounds, alpha-Diketones, and Quinones at Low Temperatures

C5H10O2; tetrahydrofurfuryl alcohol; THFA; CAS-No.: 97-99-4; PubChem: 24901453
P. Limão-Vieira, D. Duflot, M.-J. Hubin-Franskin, J. Delwiche, S.V. Hoffmann, L. Chiari, D.B. Jones, M.J. Brunger, M.C.A. Lopes J. Phys. Chem. A, 118 (33), 6425-6434, (2014) Electronic States of Tetrahydrofurfuryl Alcohol (THFA) As Studied by VUV Spectroscopy and Ab Initio Calculations

C5H10O2; 1,2-dihydroxyisoprene; 2-methylbut-3-ene-1,2-diol; CAS-No.: 24058-88-6; PubChem: CID 185554
L.N. Tran, K.A. Abellar, J.D. Cope, T.B. Nguyen J. Phys. Chem. A, 126, 37, 6517–6525, (2022) Second-Order Kinetic Rate Coefficients for the Aqueous-Phase Sulfate Radical (SO4•–) Oxidation of Some Atmospherically Relevant Organic Compounds

C7H8O2; 2,6-dimethyl-4H-pyran-4-one; 2,6-dimethyl-4-pyrone; 2,6-dimethyl-gamma-pyrone; CAS-No.: 1004-36-0; PubChem: CID 13862
A. Kuboyama, Y. Sato, H. Arano Bull. Chem. Soc. Japan, 49 (12), 3685-3686, (1976) Studies of the pi,pi* Absorption Bands of 2,6-Dimethyl-4-pyrone

C8H10O2; tyrosol; 2-(4-hydroxyphenyl)ethanol; 4-(2-hydroxyethyl)phenol; CAS-No.: 501-94-0; PubChem: CID 10393
S. Arciva, L. Ma, C. Mavis, C. Guzman, C. Anastasio Atmos. Chem. Phys., 24 (7), 4473-4485, (2024) Formation and loss of light absorbance by phenolic aqueous SOA by °OH and an organic triplet excited state

C8H10O3; vanillyl alcohol; 4-hydroxy-3-methoxybenzyl alcohol; vanillic alcohol; CAS-No.: 498-00-0; PubChem: CID 62348
S. Arciva, L. Ma, C. Mavis, C. Guzman, C. Anastasio Atmos. Chem. Phys., 24 (7), 4473-4485, (2024) Formation and loss of light absorbance by phenolic aqueous SOA by °OH and an organic triplet excited state

C8H12O4; dimethylpyrocinchonate; CAS-No.: 
R.F. Rekker, P.J. Brombacher, H. Hamann, W.T. Nauta Recueil des Travaux Chimiques des Pays-Bas, 73 (5), 410–416, (1954) Aconic acid and related compounds: I. Discussion of the structure of aconic acid

C8H12O6; gadusol; 3,4,5-trihydroxy-5-(hydroxymethyl)-2-methoxycyclohex-2-en-1-one; CAS-No.: 76663-30-4; PubChem: CID 195955
E.M. Arbeloa, S.G. Bertolotti, M.S. Churio Photochem. Photobiol. Sci., 10, 133-142, (2011) Photophysics and reductive quenching reactivity of gadusol in solution

C9H6O4; 5,7-dihydroxycoumarin; 5,7-dihydroxy-2H-chromen-2-one; CAS-No.: 2732-18-5
R.H. Goodwin, B.M. Pollock Archives of Biochem. and Biophys., 49 (1), 1-6, (1954) Ultraviolet absorption spectra of coumarin derivatives

C9H6O4; 7,8-dihydroxycoumarin; 7,8-dihydroxy-2H-chromen-2-one; daphnetin; CAS-No.: 486-35-1
R.H. Goodwin, B.M. Pollock Archives of Biochem. and Biophys., 49 (1), 1-6, (1954) Ultraviolet absorption spectra of coumarin derivatives

C9H8O2; 3,4-dihydrocoumarin; dihydrocoumarin; CAS-No.: 119-84-6; PubChem: CID 660
R.H. Goodwin, B.M. Pollock Archives of Biochem. and Biophys., 49 (1), 1-6, (1954) Ultraviolet absorption spectra of coumarin derivatives

C9H8O2; 1-phenyl-1,2-propanedione; acetylbenzoyl; benzoylacetyl; CAS-No.: 579-07-7; PubChem: CID 11363
A. Kuboyama, R. Yamazaki, S. Sanae, Y. Uehara Bull. Chem. Soc. Japan, 42 (1), 10-15, (1969) The n -> pi* Bands of Phenyl Carbonyl Compounds, alpha-Diketones, and Quinones at Low Temperatures

C9H8O3; 3-methoxyphthalide; 3-methoxy-1(3H)-isobenzofuranone; alpha-methoxyphthalide; CAS-No.: 4122-57-0
Y. Hirshberg, D. Lavie, E.D. Bergmann J. Chem. Soc., 1030-1034, (1951) The action of alcohol on phthalic anhydrides

C10H6O2; beta-naphthoquinone; 1,2-naphthoquinone; CAS-No.: 524-42-5; PubChem: CID 10667
A. Kuboyama Bull. Chem. Soc. Japan, 33 (8), 1027-1030, (1960) The n - pi* transition band of acenaphthenequinone

A. Kuboyama, R. Yamazaki, S. Sanae, Y. Uehara Bull. Chem. Soc. Japan, 42 (1), 10-15, (1969) The n -> pi* Bands of Phenyl Carbonyl Compounds, alpha-Diketones, and Quinones at Low Temperatures

A. Kuboyama, H. Arano Bull. Chem. Soc. Japan, 49 (5), 1401-1402, (1976) Studies of the pi-->pi* Absorption Bands of 1,2-Naphthoquinone

C10H6O2; alpha-naphthoquinone; 1,4-naphthoquinone; p-naphthoquinone; CAS-No.: 130-15-4; PubChem: CID 8530
A. Kuboyama Bull. Chem. Soc. Japan, 33 (8), 1027-1030, (1960) The n - pi* transition band of acenaphthenequinone

A. Kuboyama, R. Yamazaki, S. Sanae, Y. Uehara Bull. Chem. Soc. Japan, 42 (1), 10-15, (1969) The n -> pi* Bands of Phenyl Carbonyl Compounds, alpha-Diketones, and Quinones at Low Temperatures

C10H8O2; 4-methylcoumarin; 4-methylchromen-2-one; CAS-No.: 607-71-6
R.H. Goodwin, B.M. Pollock Archives of Biochem. and Biophys., 49 (1), 1-6, (1954) Ultraviolet absorption spectra of coumarin derivatives

C10H8O2; 1,2-dihydroxynaphthalene; 1,2-naphthalenediol; CAS-No.: 574-00-5; PubChem: CID 11318
C. Daglish J. Am. Chem. Soc., 72, 11, 4859-4864, (1950) The ultraviolet absorption spectra of some hydroxynaphthalenes

C10H8O2; 1,4-dihydroxynaphthalene; 1,4-naphthalenediol; CAS-No.: 571-60-8; PubChem: CID 11305
C. Daglish J. Am. Chem. Soc., 72, 11, 4859-4864, (1950) The ultraviolet absorption spectra of some hydroxynaphthalenes

C10H8O2; 1,5-dihydroxynaphthalene; 1,5-naphthalenediol; CAS-No.: 83-56-7; PubChem: CID 6749
C. Daglish J. Am. Chem. Soc., 72, 11, 4859-4864, (1950) The ultraviolet absorption spectra of some hydroxynaphthalenes

C11H10O4; 7,8-dimethoxycoumarin; 7,8-dimethoxychromen-2-one; CAS-No.: 2445-80-9; PubChem: CID 142768
S. Marciani, F. Dall’Acqua, L. Guelfi, D. Vedaldi Zeitschrift Naturforschung B, 26 (11), 1129-1136, (1971) Photoreactivity (365 nm) of Some Coumarins and 4',5'-dihydro-furocoumarins with Nucleic acids

C12H6O2; acenaphthoquinone; acenaphthylene-1,2-dione; acenaphthenequinone; CAS-No.: 82-86-0; PubChem: CID 6724
A. Kuboyama Bull. Chem. Soc. Japan, 33 (8), 1027-1030, (1960) The n - pi* transition band of acenaphthenequinone

C12H10O2; 1-naphthyl acetate; 1-acetoxynaphthalene; CAS-No.: 830-81-9; PubChem: CID 13247
C. Daglish J. Am. Chem. Soc., 72, 11, 4859-4864, (1950) The ultraviolet absorption spectra of some hydroxynaphthalenes

C12H10O2; 2-naphthyl acetate; 2-acetoxynaphthalene; CAS-No.: 1523-11-1; PubChem: CID 73709
C. Daglish J. Am. Chem. Soc., 72, 11, 4859-4864, (1950) The ultraviolet absorption spectra of some hydroxynaphthalenes

C12H10O2; 2-phenoxyphenol; o-phenoxyphenol; CAS-No.: 2417-10-9; PubChem: CID 75491
J.N. Apell, S. Kliegman, C. Sola-Gutierrez, K. McNeill Environ. Sci. Technol., 54, 22, 14432–14441, (2020) Linking Triclosan’s Structural Features to Its Environmental Fate and Photoproducts

C12H10O4; 4',5'-dihydrobergapten; CAS-No.: 10088-91-2
S. Marciani, F. Dall’Acqua, L. Guelfi, D. Vedaldi Zeitschrift Naturforschung B, 26 (11), 1129-1136, (1971) Photoreactivity (365 nm) of Some Coumarins and 4',5'-dihydro-furocoumarins with Nucleic acids

C12H12O4; 5,7-dimethoxy-4-methylcoumarin; 4-methyl-5,7-dimethoxycoumarin; CAS-No.: 6093-80-7
R.H. Goodwin, B.M. Pollock Archives of Biochem. and Biophys., 49 (1), 1-6, (1954) Ultraviolet absorption spectra of coumarin derivatives

C13H8O3; 8-hydroxyurolithin; 6H-dibenzo[b,d]pyran-6-one, 8-hydroxy-; CAS-No.: 910216-14-7
R. Gonzalez-Barrio, P. Truchado, H. Ito, J.C. Espin, F.A. Tomas-Baberan J. Agric. Food Chem., 59, 4, 1152-1162, (2011) UV and MS Identification of Urolithins and Nasutins, the Bioavailable Metabolites of Ellagitannins and Ellagic Acid in Different Mammals

C13H8O3; 3-hydroxyurolithin; urolithin B; CAS-No.: 1139-83-9; PubChem: CID 5380406
R. Gonzalez-Barrio, P. Truchado, H. Ito, J.C. Espin, F.A. Tomas-Baberan J. Agric. Food Chem., 59, 4, 1152-1162, (2011) UV and MS Identification of Urolithins and Nasutins, the Bioavailable Metabolites of Ellagitannins and Ellagic Acid in Different Mammals

C13H8O4; urolithin A; 3,8-dihydroxyurolithin; CAS-No.: 1143-70-0; PubChem: CID 5488186
R. Gonzalez-Barrio, P. Truchado, H. Ito, J.C. Espin, F.A. Tomas-Baberan J. Agric. Food Chem., 59, 4, 1152-1162, (2011) UV and MS Identification of Urolithins and Nasutins, the Bioavailable Metabolites of Ellagitannins and Ellagic Acid in Different Mammals

C13H8O4; isourolithin A; 3,9-dihydroxyurolithin; CAS-No.: 174023-48-4; PubChem: CID 10376459
R. Gonzalez-Barrio, P. Truchado, H. Ito, J.C. Espin, F.A. Tomas-Baberan J. Agric. Food Chem., 59, 4, 1152-1162, (2011) UV and MS Identification of Urolithins and Nasutins, the Bioavailable Metabolites of Ellagitannins and Ellagic Acid in Different Mammals

C13H8O5; urolithin C; 3,8,9-trihydroxyurolithin; CAS-No.: 165393-06-6; PubChem: CID
R. Gonzalez-Barrio, P. Truchado, H. Ito, J.C. Espin, F.A. Tomas-Baberan J. Agric. Food Chem., 59, 4, 1152-1162, (2011) UV and MS Identification of Urolithins and Nasutins, the Bioavailable Metabolites of Ellagitannins and Ellagic Acid in Different Mammals

C13H8O5; urolithin M7; 3,8,10-trihydroxy-6H-benzo[c]chromen-6-one; CAS-No.: 531512-26-2; PubChem: CID 53647525
R. Gonzalez-Barrio, P. Truchado, H. Ito, J.C. Espin, F.A. Tomas-Baberan J. Agric. Food Chem., 59, 4, 1152-1162, (2011) UV and MS Identification of Urolithins and Nasutins, the Bioavailable Metabolites of Ellagitannins and Ellagic Acid in Different Mammals

C13H8O6; urolithin M6; 3,8,9,10-tetrahydroxy-urolithin; CAS-No.: 1006683-97-1; PubChem: CID 101461104
R. Gonzalez-Barrio, P. Truchado, H. Ito, J.C. Espin, F.A. Tomas-Baberan J. Agric. Food Chem., 59, 4, 1152-1162, (2011) UV and MS Identification of Urolithins and Nasutins, the Bioavailable Metabolites of Ellagitannins and Ellagic Acid in Different Mammals

C13H8O7; urolithin M5; 3,4,8,9,10-pentahydroxyurolithin; CAS-No.: 91485-02-8; PubChem:
R. Gonzalez-Barrio, P. Truchado, H. Ito, J.C. Espin, F.A. Tomas-Baberan J. Agric. Food Chem., 59, 4, 1152-1162, (2011) UV and MS Identification of Urolithins and Nasutins, the Bioavailable Metabolites of Ellagitannins and Ellagic Acid in Different Mammals

C13H10O; p-phenylbenzaldehyde; 4-biphenylaldehyde; 4-phenylbenzaldehyde; CAS-No.: 3218-36-8; PubChem: CID 76689
H. Suzuki Bull. Chem. Soc. Japan, 33 (5), 613-618, (1960) Relations between Electronic Absorption Spectra and Spatial Configurations of Conjugated Systems. X. Benzaldehyde,  Acetophenone and Related Compounds

C13H10O2; 2-phenyl-benzodioxole; 1,3-benzodioxole, 2-phenyl-; CAS-No.: 7527-52-8; PubChem: CID 11030780
B. Wang, J. Yang, J. Nie, X. Zhu Photochem. Photobiol. Sci.,13, 651-659, (2014) Synthesis and photopolymerization kinetics of 2-phenyl-benzodioxole

C13H10O3; diphenylcarbonate; carbonic acid, diphenyl ester; phenyl carbonate; CAS-No.: 102-09-0; PubChem: CID 7597
C.E. Hoyle, I.B. Rufus, H. Shah Can. J. Chem., 73 (11), 2062-2068, (1995) Solvent effect on the photophysics of bisphenol-A-based polycarbonate and diphenylcarbonate

C13H10O3; 2,2'-dihydroxybenzophenone; bis(2-hydroxyphenyl)methanone; CAS-No.: 835-11-0; PubChem: CID 70038
A. Retzow, W. Wiegrebe Scientia Pharmaceutica, 53, 209-221, (1985) Dithranol-Anion: UV/Vis-Spektrum und chemische Reaktivität

C13H12O2; 2-acetyl-6-methoxynaphthalene; 6'-methoxy-2'-acetonaphthone; CAS-No.: 3900-45-6; PubChem: CID 77506
R. Marotta, D. Spasiano, I. Di Somma, R. Andreozzi Water Research, 47 (1), 373-383, (2013) Photodegradation of naproxen and its photoproducts in aqueous solution at 254 nm: A kinetic investigation

C13H12O2; 2,2'-methylenediphenol; 2,2'-dihydroxydiphenylmethane; CAS-No.: 2467-02-9; PubChem: CID 75575
R.F. Hunter, R.A. Morton, A.T. Carpenter J. Chem. Soc.,0, 441-444, (1950) The ultra-violet absorption spectra of 2:2'-, 2:4'-, 4:4'-dihydroxydiphenylmethanes, 2:2'-dihydroxy-5:5'-dimethyldiphenylmethane  and its 3-, 4-, and 5-ring polymers, and of 4:4'-dihydroxydiphenylethane

C13H12O2; 2,4'-methylenediphenol; 2,4'-dihydroxydiphenylmethane; CAS-No.: 2467-03-0; PubChem: CID 75576
R.F. Hunter, R.A. Morton, A.T. Carpenter J. Chem. Soc.,0, 441-444, (1950) The ultra-violet absorption spectra of 2:2'-, 2:4'-, 4:4'-dihydroxydiphenylmethanes, 2:2'-dihydroxy-5:5'-dimethyldiphenylmethane  and its 3-, 4-, and 5-ring polymers, and of 4:4'-dihydroxydiphenylethane

C13H12O2; 4,4'-methylenediphenol; 4,4'-dihydroxydiphenylmethane; CAS-No.: 620-92-8; PubChem: CID 12111
R.F. Hunter, R.A. Morton, A.T. Carpenter J. Chem. Soc.,0, 441-444, (1950) The ultra-violet absorption spectra of 2:2'-, 2:4'-, 4:4'-dihydroxydiphenylmethanes, 2:2'-dihydroxy-5:5'-dimethyldiphenylmethane  and its 3-, 4-, and 5-ring polymers, and of 4:4'-dihydroxydiphenylethane

C13H14O2; 1-(6-methoxy-2-naphthyl)ethanol; (1RS)-1-(6-methoxynaphthalen-2-yl)ethanol; CAS-No.: 77301-42-9
R. Marotta, D. Spasiano, I. Di Somma, R. Andreozzi Water Research, 47 (1), 373-383, (2013) Photodegradation of naproxen and its photoproducts in aqueous solution at 254 nm: A kinetic investigation

C13H16O5; ethyl-sinapate; ethyl 4-hydroxy-3,5-dimethoxycinnamate; CAS-No.: 41628-47-1
M.D. Horbury, M.A.P. Turner, J.S. Peters, M. Mention, A.L. Flourat, N.D.M. Hine, F. Allais, V.G. Stavros Front. Chem., 8, 633, (2020) Exploring the Photochemistry of an Ethyl Sinapate Dimer: An Attempt Toward a Better Ultraviolet Filter

C14H8O2; phenanthrenequinone; 9,10-phenanthrenequinone; CAS-No.: 84-11-7; PubChem: CID 6763
T.R. Hogness, A.E. Sidwell Jr., F.P. Zscheile Jr. J. Biol. Chem., 120, 239-256, (1937) The absorption spectra of compounds related to the sterols

A. Kuboyama Bull. Chem. Soc. Japan, 33 (8), 1027-1030, (1960) The n - pi* transition band of acenaphthenequinone

A. Kuboyama, F. Kobayashi, S. Morokuma Bull. Chem. Soc. Japan, 48 (7), 2145-2148, (1975) Studies of the pi-->pi* Absorption Bands of 9,10-Phenanthrenequinone

C14H8O2; anthraquinone; 9,10-anthraquinone; anthracene-9,10-dione; CAS-No.: 84-65-1; PubChem: CID 6780
A. Kuboyama Bull. Chem. Soc. Japan, 52 (2), 329-333, (1979) The Low-Energy pi,pi* S-S Absorption Spectra of 1,4-Dimethyl-and 1,4-Dichloroanthraquinones

C14H10O; 2-formylfluorene; 2-fluorenecarboxaldehyde; CAS-No.: 30084-90-3
H. Suzuki Bull. Chem. Soc. Japan, 33 (5), 613-618, (1960) Relations between Electronic Absorption Spectra and Spatial Configurations of Conjugated Systems. X. Benzaldehyde,  Acetophenone and Related Compounds

C14H10O; 9-anthrone; 9(10H)-anthracenone; anthranone; CAS-No.: 90-44-8; PubChem: CID 7018
A. Retzow, W. Wiegrebe Scientia Pharmaceutica, 53, 209-221, (1985) Dithranol-Anion: UV/Vis-Spektrum und chemische Reaktivität

C14H10O2; benzil; diphenylethanedione; 1,2-diphenylethane-1,2-dione; CAS-No.: 134-81-6; PubChem: CID 8651
A. Kuboyama, R. Yamazaki, S. Sanae, Y. Uehara Bull. Chem. Soc. Japan, 42 (1), 10-15, (1969) The n -> pi* Bands of Phenyl Carbonyl Compounds, alpha-Diketones, and Quinones at Low Temperatures

T.A. Alsalim, J.S. Hadi, O.N. Ali, H.S. Abbo, S.J.J. Titinchi Chem. Cent. J., 7 (3), 1-8, (2013) Oxidation of benzoin catalyzed by oxovanadium(IV) schiff base complexes

C14H12O; desoxybenzoin; 2-phenylacetophenone; deoxybenzoin; CAS-No.: 451-40-1; PubChem: CID 9948
A. Kuboyama, R. Yamazaki, S. Sanae, Y. Uehara Bull. Chem. Soc. Japan, 42 (1), 10-15, (1969) The n -> pi* Bands of Phenyl Carbonyl Compounds, alpha-Diketones, and Quinones at Low Temperatures

C14H12O; p-phenylacetophenone; 4-phenylacetophenone; 4-acetylbiphenyl; CAS-No.: 92-91-1; PubChem: CID 7113
H. Suzuki Bull. Chem. Soc. Japan, 33 (5), 613-618, (1960) Relations between Electronic Absorption Spectra and Spatial Configurations of Conjugated Systems. X. Benzaldehyde,  Acetophenone and Related Compounds

C14H12O2; benzoin; 2-hydroxy-1,2-diphenylethan-1-one; 2-hydroxy-1,2-diphenylethanone; CAS-No.: 119-53-9; PubChem: CID 8400
T.A. Alsalim, J.S. Hadi, O.N. Ali, H.S. Abbo, S.J.J. Titinchi Chem. Cent. J., 7 (3), 1-8, (2013) Oxidation of benzoin catalyzed by oxovanadium(IV) schiff base complexes

C14H12O2; 4,4'-dihydroxystilbene; 4,4'-dioxystilbene; CAS-No.: 659-22-3; PubChem: CID 5282363
E. Havinga, R.J.F. Nivard Recueil des Travaux Chimiques des Pays-Bas, 67 (11), 846-854, (1948) Ultraviolet absorption spectra and stereochemical structure of plant growth substances of the cis cinnamic acid type and stilboestrol

C14H12O3; desmethoxyyangonin; 5,6-dehydrokawain; 4-methoxy-6-[(E)-2-phenylethenyl]-2H-pyran-2-one; CAS-No.: 15345-89-8
I. Chmielewska, J. Cieslak, K. Gorczynska, B. Kontnik, K. Pitakowska Tetrahedron, 4, 36-42, (1958) Structure de la yangonine étude spectrographique dans l'ultraviolet et l'infrarouge

C14H12O3; desmethoxypseudoyangonin; CAS-No.: 
I. Chmielewska, J. Cieslak, K. Gorczynska, B. Kontnik, K. Pitakowska Tetrahedron, 4, 36-42, (1958) Structure de la yangonine étude spectrographique dans l'ultraviolet et l'infrarouge

C14H14O; dibenzyl ether; benzyl ether; 1,1'-[Oxybis(methylene)]dibenzene; CAS-No.: 103-50-4
H.P. Koch J. Chem. Soc., 387-394, (1949) Absorption spectra and structure of organic sulphur compounds. Part I. Unsaturated Sulphides

C14H14O2; 4,4'-ethylenediphenol; 4,4'-dihydroxydiphenylethane; CAS-No.: 
R.F. Hunter, R.A. Morton, A.T. Carpenter J. Chem. Soc.,0, 441-444, (1950) The ultra-violet absorption spectra of 2:2'-, 2:4'-, 4:4'-dihydroxydiphenylmethanes, 2:2'-dihydroxy-5:5'-dimethyldiphenylmethane  and its 3-, 4-, and 5-ring polymers, and of 4:4'-dihydroxydiphenylethane

C14H14O2; 2,2'-dimethoxybiphenyl; 2,2-dimethoxy-1,1-biphenyl; CAS-No.: 4877-93-4; PubChem: CID 611816
B. Williamson, W.H. Rodebush J. Am. Chem. Soc., 63, 11, 3018-3025, (1941) Ultraviolet absorption spectra of organic molecules: II. The effect of substituent groups upon the absorption of biphenyl

C14H14O3; dihydrodesmethoxyyangonin; CAS-No.:
I. Chmielewska, J. Cieslak, K. Gorczynska, B. Kontnik, K. Pitakowska Tetrahedron, 4, 36-42, (1958) Structure de la yangonine étude spectrographique dans l'ultraviolet et l'infrarouge

C14H14O3; dihydrodesmethoxypseudoyangonin; CAS-No.:
I. Chmielewska, J. Cieslak, K. Gorczynska, B. Kontnik, K. Pitakowska Tetrahedron, 4, 36-42, (1958) Structure de la yangonine étude spectrographique dans l'ultraviolet et l'infrarouge

C15H12O3; 7-hydroxyflavanone; 7-hydroxy-2-phenylchroman-4-one; CAS-No.: 6515-36-2; PubChem: CID 1890
T. Wróblewski, D.V. Ushakou Spectrochim. Acta A: Mol. Biomol. Spectroscopy, 215, 81-87, (2019) Photophysical properties of 7-hydroxyflavanone: Quantum chemical calculations and experimental studies

C14H22O; n-methylpseudoionone; pseudomethylionone; 7,11-dimethyldodeca-4,6,10-trien-3-one; CAS-No.: 26651-96-7; PubChem: 94373
R.M. Lusskin, L. Winston J. Am. Chem. Soc., 71 (7), 2412-2414, (1949) Ultraviolet absorption spectra in the methyl ionone series

C14H22O; alpha-n-methylionone; 1-penten-3-one, 1-(2,6,6-trimethyl-2-cyclohexen-1-yl)-; CAS-No.: 7779-30-8
R.M. Lusskin, L. Winston J. Am. Chem. Soc., 71 (7), 2412-2414, (1949) Ultraviolet absorption spectra in the methyl ionone series

C14H22O; beta-n-methylionone; CAS-No.: 127-43-5
R.M. Lusskin, L. Winston J. Am. Chem. Soc., 71 (7), 2412-2414, (1949) Ultraviolet absorption spectra in the methyl ionone series

C14H22O; alpha-isomethylionone; alpha-ionone, isomethyl; CAS-No.: 127-51-5
R.M. Lusskin, L. Winston J. Am. Chem. Soc., 71 (7), 2412-2414, (1949) Ultraviolet absorption spectra in the methyl ionone series

C14H22O; beta-isomethylionone; beta-ionone, isomethyl-; CAS-No.: 79-89-0
R.M. Lusskin, L. Winston J. Am. Chem. Soc., 71 (7), 2412-2414, (1949) Ultraviolet absorption spectra in the methyl ionone series

C14H22O; iso-methylpseudoionone; methylisopseudoionone; CAS-No.: 5659-78-9; PubChem: 6436890
R.M. Lusskin, L. Winston J. Am. Chem. Soc., 71 (7), 2412-2414, (1949) Ultraviolet absorption spectra in the methyl ionone series

C15H10O2; 2-methylanthraquinone; tectoquinone; 2-methylanthracene-9,10-dione; CAS-No.: 84-54-8; PubChem: CID 6773
A. Kuboyama, R. Yamazaki, S. Sanae, Y. Uehara Bull. Chem. Soc. Japan, 42 (1), 10-15, (1969) The n -> pi* Bands of Phenyl Carbonyl Compounds, alpha-Diketones, and Quinones at Low Temperatures

C15H12O; 2-hydroxymethylphenathrene; phenanthren-2-ylmethanol; CAS-No.: 2606-54-4; PubChem: CID 13477024
S. Akiyama, M. Nakagawa, K. Nishimoto Bull. Chem. Soc. Japan, 44 (4), 1054-1062, (1971) Electronic spectra of phenanthrene derivatives. Effect of substitution

C15H12O; 3-hydroxymethylphenathrene; phenanthren-3-ylmethanol; CAS-No.: 22863-78-1
S. Akiyama, M. Nakagawa, K. Nishimoto Bull. Chem. Soc. Japan, 44 (4), 1054-1062, (1971) Electronic spectra of phenanthrene derivatives. Effect of substitution

C15H12O; 9-hydroxymethylphenathrene; phenanthren-9-ylmethanol; CAS-No.: 4707-72-6
S. Akiyama, M. Nakagawa, K. Nishimoto Bull. Chem. Soc. Japan, 44 (4), 1054-1062, (1971) Electronic spectra of phenanthrene derivatives. Effect of substitution

C15H12O; 1-methoxy-2-(phenylethynyl)benzene; methoxydiphenylacetylene; 2-(phenylethynyl)anisole; CAS-No.: 41398-67-8; PubChem: CID 10910751
A.R. Melnikov, M.P. Davydova, P.S. Sherin, V.V. Korelev, A.A.Stepanov, E.V. Kalneus, E. Benassi, S.F. Vasilevsky, D.V. Stass J. Phys. Chem. A, 122 (5), 1235-1252, (2018) X-Ray Generated Recombination Exciplexes of Substituted Diphenylacetylenes with Tertiary Amines: A Versatile Experimental Vehicle for Targeted Creation of Deep-Blue Electroluminescent Systems

C15H12O; 1-methoxy-3-(phenylethynyl)benzene; M-(phenylethynyl)anisole; CAS-No.: 37696-01-8; PubChem: CID 11401525
A.R. Melnikov, M.P. Davydova, P.S. Sherin, V.V. Korelev, A.A.Stepanov, E.V. Kalneus, E. Benassi, S.F. Vasilevsky, D.V. Stass J. Phys. Chem. A, 122 (5), 1235-1252, (2018) X-Ray Generated Recombination Exciplexes of Substituted Diphenylacetylenes with Tertiary Amines: A Versatile Experimental Vehicle for Targeted Creation of Deep-Blue Electroluminescent Systems

C15H12O; 1-methoxy-4-(phenylethynyl)benzene; 4-(phenylethynyl)anisole; CAS-No.: 7380-78-1; PubChem: CID 610402
A.R. Melnikov, M.P. Davydova, P.S. Sherin, V.V. Korelev, A.A.Stepanov, E.V. Kalneus, E. Benassi, S.F. Vasilevsky, D.V. Stass J. Phys. Chem. A, 122 (5), 1235-1252, (2018) X-Ray Generated Recombination Exciplexes of Substituted Diphenylacetylenes with Tertiary Amines: A Versatile Experimental Vehicle for Targeted Creation of Deep-Blue Electroluminescent Systems

C15H12O; 2-acetylfluorene; 2-fluorenyl methyl ketone; 2-acetofluorene; CAS-No.: 781-73-7; PubChem: CID 69908
H. Suzuki Bull. Chem. Soc. Japan, 33 (5), 613-618, (1960) Relations between Electronic Absorption Spectra and Spatial Configurations of Conjugated Systems. X. Benzaldehyde, Acetophenone and Related Compounds

C15H18O3; santonin; alpha-santonin; CAS-No.: 481-06-1; PubChem: CID 221071
A. Kuboyama, Y. Sato, F. Kobayashi Bull. Chem. Soc. Japan, 48 (11), 3381-3382, (1975) Studies of the pi-->pi* Absorption Bands of alpha-Santonin

C15H10O4; chrysophanol; chrysophanic acid; 1,8-dihydroxy-3-methylanthraquinone; CAS-No.: 481-74-3; PubChem: CID 10208
Z. Markovic, N. Manojlovic, S. Zlatanovic J. Serbian Soc. Computational Mechanics, 2 (2), 73-79, (2008) Electronic Absorption Spectra of Substituted Anthraquinones and Their Simulation Using ZINDO/S Method

C15H10O7; quercetin; 3',4',5,7-tetrahydroxyflavon-3-ol; CAS-No.: 117-39-5; PubChem: CID 5280343
R.E. Stuckey J. Pharmacy Pharmacology, 4 (1), 345-365, (1952) The applications of ultra-violet absorption spectrophotometry in pharmaceutical analysis

G. Weiz, J.D. Breccia, L.S. Mazzaferro Food Chemistry, 229, 44-49, (2017) Screening and quantification of the enzymatic deglycosylation of the plant flavonoid rutin by UV-visible spectrometry

C15H10O8; myricetin; cannabiscetin; myricetol; CAS-No.: 529-44-2; PubChem: CID 5281672
related data (quantum yield studies; photolysis studies, linear dichroism spectroscopy etc.)
D. Vojta, E.M. Karlsen, J. Spanget-Larsen Spectrochim. Acta A, 173, 182-187, (2017) Electronic states of Myricetin. UV-Vis polarization spectroscopy and quantum chemical calculations

C15H14O4; yangonin; 4-methoxy-6-[(E)-2-(4-methoxyphenyl)ethenyl]pyran-2-one; CAS-No.: 500-62-9; PubChem: CID 5281575
I. Chmielewska, J. Cieslak, K. Gorczynska, B. Kontnik, K. Pitakowska Tetrahedron, 4, 36-42, (1958) Structure de la yangonine étude spectrographique dans l'ultraviolet et l'infrarouge

C15H14O4; pseudoyangonin; CAS-No.: 
I. Chmielewska, J. Cieslak, K. Gorczynska, B. Kontnik, K. Pitakowska Tetrahedron, 4, 36-42, (1958) Structure de la yangonine étude spectrographique dans l'ultraviolet et l'infrarouge

C15H16O; 4,4'-dimethylbenzhydrol; di-p-tolylmethanol; bis(4-methylphenyl)methanol; CAS-No.: 885-77-8; PubChem: CID 279356
R.F. Rekker, W.T. Nauta Recueil Travaux Chimiques Pays-Bas, 87 (10), 1099-1109, (1968) The UV absorption of substituted benzhydrols and of the corresponding 2-(dimethylamino)ethyl ethers

C15H16O2; 2,2'-dihydroxy-5,5'-dimethyldiphenylmethane; 2,2'-methylenebis(4-methylphenol); 2,2'-methylendi-p-cresol; CAS-No.: 3236-63-3
R.F. Hunter, R.A. Morton, A.T. Carpenter J. Chem. Soc.,0, 441-444, (1950) The ultra-violet absorption spectra of 2:2'-, 2:4'-, 4:4'-dihydroxydiphenylmethanes, 2:2'-dihydroxy-5:5'-dimethyldiphenylmethane  and its 3-, 4-, and 5-ring polymers, and of 4:4'-dihydroxydiphenylethane

C14H6O4; 1,4,9,10-anthracenetetrone; 1,4,9,10-anthradiquinone; CAS-No.: 1709-63-3; PubChem: CID 137169
A. Kuboyama, K. Wada Bull. Chem. Soc. Japan, 38 (4), 569-572, (1965) Electronic Spectra of 1,4,9,10-Anthradiquinone and Its Complexes with Aromatics

C14H6O6; nasutin A; 4,9-dehydroxy ellagic acid; CAS-No.: 71540-38-5; PubChem: CID 5909486
R. Gonzalez-Barrio, P. Truchado, H. Ito, J.C. Espin, F.A. Tomas-Baberan J. Agric. Food Chem., 59, 4, 1152-1162, (2011) UV and MS Identification of Urolithins and Nasutins, the Bioavailable Metabolites of Ellagitannins and Ellagic Acid in Different Mammals

G. Mazzone, M. Toscano, N. Russo J. Agric. Food Chem., 61, 40, 9650–9657, (2013) Density Functional Predictions of Antioxidant Activity and UV Spectral Features of Nasutin A, Isonasutin, Ellagic Acid, and One of Its Possible Derivatives

C14H6O6; isonasutin; CAS-No.:
G. Mazzone, M. Toscano, N. Russo J. Agric. Food Chem., 61, 40, 9650–9657, (2013) Density Functional Predictions of Antioxidant Activity and UV Spectral Features of Nasutin A, Isonasutin, Ellagic Acid, and One of Its Possible Derivatives

C14H8O4; alizarin; 1,2-dihydroxyanthracene-9,10-dione; 1,2-dihydroxyanthraquinone; CAS-No.: 72-48-0; PubChem: CID 6293
S. Markovic, J. Tosovic J. Phys. Chem. A, 119 (35), 9352-9362, (2015) Application of Time-Dependent Density Functional and Natural Bond Orbital Theories to the UV-vis Absorption Spectra of Some Phenolic Compounds

C14H8O4; quinizarin; 1,4-dihydroxy-9,10-anthraquinone; CAS-No.: 81-64-1; PubChem: CID 6688
related data (quantum yield studies; photolysis studies, linear dichroism spectroscopy etc.)
D.D. Nguyen, N.C. Jones, S.V. Hoffmann, J. Spanget-Larsen Spectrochim. Acta A: Mol. and Biomol. Spectr., 77 (1), 279-286, (2010) Synchrotron radiation linear dichroism (SRLD) investigation of the electronic transitions of quinizarin, chrysazin, and anthrarufin

C14H8O4; anthrarufin; 1,5-dihydroxy-9,10-anthraquinone; CAS-No.: 117-12-4; PubChem: CID 8328
related data (quantum yield studies; photolysis studies, linear dichroism spectroscopy etc.)
D.D. Nguyen, N.C. Jones, S.V. Hoffmann, J. Spanget-Larsen Spectrochim. Acta A: Mol. and Biomol. Spectr., 77 (1), 279-286, (2010) Synchrotron radiation linear dichroism (SRLD) investigation of the electronic transitions of quinizarin, chrysazin, and anthrarufin

C14H8O4; chrysazin; danthron; 1,8-dihydroxy-9,10-anthraquinone; CAS-No.: 117-10-2; PubChem: CID 2950
T.S. Melo, L. Dubertret, P. Prognon, A. Gond, G. Mahuzier, R. Santus J. Invest. Dermatology, 80 (1), 1-6, (1983) Physicochemical Properties and Stability of Anthralin in Model Systems and Human Skin

related data (quantum yield studies; photolysis studies, linear dichroism spectroscopy etc.)
D.D. Nguyen, N.C. Jones, S.V. Hoffmann, J. Spanget-Larsen Spectrochim. Acta A: Mol. and Biomol. Spectr., 77 (1), 279-286, (2010) Synchrotron radiation linear dichroism (SRLD) investigation of the electronic transitions of quinizarin, chrysazin, and anthrarufin

C15H16O4; 5,6-dihydroyangonin; CAS-No.: 3328-60-7; PubChem: CID 11623055
I. Chmielewska, J. Cieslak, K. Gorczynska, B. Kontnik, K. Pitakowska Tetrahedron, 4, 36-42, (1958) Structure de la yangonine étude spectrographique dans l'ultraviolet et l'infrarouge

C15H16O4; dihydropseudoyangonin; CAS-No.: 
I. Chmielewska, J. Cieslak, K. Gorczynska, B. Kontnik, K. Pitakowska Tetrahedron, 4, 36-42, (1958) Structure de la yangonine étude spectrographique dans l'ultraviolet et l'infrarouge

C15H10O5; emodin; 1,3,8-trihydroxy-6-methylanthracene-9,10-dione; CAS-No.: 518-82-1; PubChem: CID 3220
Z. Markovic, N. Manojlovic, S. Zlatanovic J. Serbian Soc. Computational Mechanics, 2 (2), 73-79, (2008) Electronic Absorption Spectra of Substituted Anthraquinones and Their Simulation Using ZINDO/S Method

S. Markovic, J. Tosovic J. Phys. Chem. A, 119 (35), 9352-9362, (2015) Application of Time-Dependent Density Functional and Natural Bond Orbital Theories to the UV-vis Absorption Spectra of Some Phenolic Compounds

related data (quantum yield studies; photolysis studies, linear dichroism spectroscopy etc.)
S.C. Nguyen, B.K. Vilster Hansen, S.V. Hoffmann, J. Spanget-Larsen Chem. Phys., 352 (1-3), 167-174, (2008) Electronic states of emodin and its conjugate base. Synchrotron linear dichroism spectroscopy and quantum chemical calculations

C15H9O5-; emodin (deprotonated); 3-oxido-6-methyl-1,8-dihydroxy-9,10-anthraquinone; CAS-No.:
related data (quantum yield studies; photolysis studies, linear dichroism spectroscopy etc.)
S.C. Nguyen, B.K. Vilster Hansen, S.V. Hoffmann, J. Spanget-Larsen Chem. Phys., 352 (1-3), 167-174, (2008) Electronic states of emodin and its conjugate base. Synchrotron linear dichroism spectroscopy and quantum chemical calculations

C15H14O6; L-epicatechin; (-)-epicatechin; CAS-No.: 490-46-0; PubChem: CID 72276
L. Jurd Archives Biochem. Biophys., 66, 284-288, (1957) The detection of aromatic acids in plant extracts by the ultraviolet absorption spectra of their ions

C16H12O; 2-acetylphenanthrene; methyl 2-phenanthryl ketone; CAS-No.: 5960-69-0; PubChem: CID 80060
S. Akiyama, M. Nakagawa, K. Nishimoto Bull. Chem. Soc. Japan, 44 (4), 1054-1062, (1971) Electronic spectra of phenanthrene derivatives. Effect of substitution

C16H12O; 3-acetylphenanhrene; 1-(3-phenanthryl)ethanone; CAS-No.: 2039-76-1; PubChem: CID 74867
S. Akiyama, M. Nakagawa, K. Nishimoto Bull. Chem. Soc. Japan, 44 (4), 1054-1062, (1971) Electronic spectra of phenanthrene derivatives. Effect of substitution

C16H12O; 9-acetylphenanthrene; 1-(9-phenanthryl)ethanone; CAS-No.: 2039-77-2; PubChem: CID 74868
S. Akiyama, M. Nakagawa, K. Nishimoto Bull. Chem. Soc. Japan, 44 (4), 1054-1062, (1971) Electronic spectra of phenanthrene derivatives. Effect of substitution

C16H12O2; 2,3-dimethylanthraquinone; 2,3-dimethylanthracene-9,10-dione; CAS-No.: 6531-35-7; PubChem: CID 81019
A. Kuboyama Bull. Chem. Soc. Japan, 52 (2), 329-333, (1979) The Low-Energy pi,pi* S-S Absorption Spectra of 1,4-Dimethyl-and 1,4-Dichloroanthraquinones

C16H12O2; 1,4-dimethylanthraquinone; 1,4-dimethylanthracene-9,10-dione; CAS-No.: 1519-36-4
A. Kuboyama Bull. Chem. Soc. Japan, 52 (2), 329-333, (1979) The Low-Energy pi,pi* S-S Absorption Spectra of 1,4-Dimethyl-and 1,4-Dichloroanthraquinones

C16H12O4; dithranol monoacetate; CAS-No.:
A. Retzow, W. Wiegrebe Scientia Pharmaceutica, 53, 209-221, (1985) Dithranol-Anion: UV/Vis-Spektrum und chemische Reaktivität

C16H12O5; physcion; 1,8-dihydroxy-3-methoxy-6-methylanthraquinone; emodin-3-methyl ether; CAS-No.: 521-61-9; PubChem: CID 10639
Z. Markovic, N. Manojlovic, S. Zlatanovic J. Serbian Soc. Computational Mechanics, 2 (2), 73-79, (2008) Electronic Absorption Spectra of Substituted Anthraquinones and Their Simulation Using ZINDO/S Method

C17H12O2; 2,6-diphenyl-4H-pyran-4-one; 2,6-diphenyl-4-pyrone; CAS-No.: 1029-94-3; PubChem: CID 283227
N. Ishibe, H. Sugimoto, J.B. Gallivan J. Chem. Soc., Faraday Trans. 2,71, 1812-1822, (1975) Electronic absorption and emission spectra of 4-pyrones, 4-thiopyrones and 4-pyridones

C17H12O6; aflatoxin B1; NSC529592; AFBI; CAS-No.: 1162-65-8; PubChem: CID 14403
J. Nabney, B.F. Nesbitt Analyst, 90, 155-160, (1965) A spectrophotometric method for determining the aflatoxins

C18H14O5; dithranol diacetate; CAS-No.:
A. Retzow, W. Wiegrebe Scientia Pharmaceutica, 53, 209-221, (1985) Dithranol-Anion: UV/Vis-Spektrum und chemische Reaktivität

C18H20O2; diethylstilbestrol; stilbestrol; silboestrol; CAS-No.: 56-53-1; PubChem: CID 448537
E. Kaiser, V.L. Koenig J. Am. Chem. Soc., 68 (5), 740-742, (1946) The ultraviolet absorption spectra of allyl and propenyl substituted derivatives of diethylstilbestrol and hexestrol

E. Havinga, R.J.F. Nivard Recueil des Travaux Chimiques des Pays-Bas, 67 (11), 846-854, (1948) Ultraviolet absorption spectra and stereochemical structure of plant growth substances of the cis cinnamic acid type and stilboestrol

J.M. Goodyear, L.S. Hatfield, M.M. Marsh J. Pharmaceutical Sciences, 43 (10), 605-608, (1954) Ultraviolet irradiation and absorptiometric methods for the determination of diethylstilbestrol in tablets

C18H22O2; hexestrol; dihydrodiethylstilbestrol; CAS-No.: 84-16-2; PubChem: CID 3606
E. Kaiser, V.L. Koenig J. Am. Chem. Soc., 68 (5), 740-742, (1946) The ultraviolet absorption spectra of allyl and propenyl substituted derivatives of diethylstilbestrol and hexestrol

C18H26O3; octyl methoxycinnamate; ethylhexyl methoxycinnamate; octinoxate; CAS-No.: 5466-77-3; PubChem: CID 5355130
N. Oguchi-Fujiyama, K. Miyazawa, A. Kikuchi, M. Yagi Photochem. Photobiol. Sci., 11, 1528-1535, (2012) Photophysical properties of dioctyl 4-methoxybenzylidenemalonate: UV-B absorber

K.M. Hanson, S. Narayanan, V.M. Nichols, C.J. Bardeen Photochem. Photobiol. Sciences, 14, 1607-1616, (2015) Photochemical Degradation of the UV Filter Octyl Methoxycinnamate in Solution and in Aggregates

C19H16O2; 2,6-dimethyl-3,5-diphenyl-4H-pyran-4-one; 2,6-dimethyl-3,5-diphenyl-4-pyrone; CAS-No.: 33731-54-3
N. Ishibe, H. Sugimoto, J.B. Gallivan J. Chem. Soc., Faraday Trans. 2,71, 1812-1822, (1975) Electronic absorption and emission spectra of 4-pyrones, 4-thiopyrones and 4-pyridones

C19H16O9; urolithin B 3-O-glucuronide; urolithin B glucuronide; CAS-No.: 823806-74-2; PubChem: CID 101495881
R. Gonzalez-Barrio, P. Truchado, H. Ito, J.C. Espin, F.A. Tomas-Baberan J. Agric. Food Chem., 59, 4, 1152-1162, (2011) UV and MS Identification of Urolithins and Nasutins, the Bioavailable Metabolites of Ellagitannins and Ellagic Acid in Different Mammals

C19H16O10; urolithin A glucuronide; urolithin A 3-O-glucuronide; CAS-No.: 1365982-52-0; PubChem: CID 102579638
R. Gonzalez-Barrio, P. Truchado, H. Ito, J.C. Espin, F.A. Tomas-Baberan J. Agric. Food Chem., 59, 4, 1152-1162, (2011) UV and MS Identification of Urolithins and Nasutins, the Bioavailable Metabolites of Ellagitannins and Ellagic Acid in Different Mammals

C19H24O2; estrone 3-methyl ether; estrone methyl ether; CAS-No.: 1624-62-0; PubChem: CID 92895
O.H. Wheeler, J.L. Mateos J. Org. Chem., 21 (10), 1110-1112, (1956) The Ultraviolet Absorption of Isolated Double Bonds

C19H28O2; testosterone; CAS-No.: 58-22-0; PubChem: CID 6013
H.-W. Yu, M. Park, S. Wu, I.J. Lopez, W. Ji, J. Scheideler, S.A. Snyder Water Research, 166, 115030, (2019) Strategies for selecting indicator compounds to assess attenuation of emerging contaminants during UV advanced oxidation processes

C20H16O6; 1,8,9-triacetoxyanthracene; triacetyldithranol; dithranol triacetate; exolan; CAS-No.: 16203-97-7; PubChem: CID 27751
A. Retzow, W. Wiegrebe Scientia Pharmaceutica, 53, 209-221, (1985) Dithranol-Anion: UV/Vis-Spektrum und chemische Reaktivität

C20H22O3; 4-tert-butyl-4'-methoxy-dibenzoylmethane; avobenzone; BMDBM; CAS-No.: 70356-09-1; PubChem: CID 51040
N. Oguchi-Fujiyama, K. Miyazawa, A. Kikuchi, M. Yagi Photochem. Photobiol. Sci., 11, 1528-1535, (2012) Photophysical properties of dioctyl 4-methoxybenzylidenemalonate: UV-B absorber

C20H22O5; desacetamidocolchicine; CAS-No.: 1420-08-2; PubChem: CID 14995
S.N. Maity, B. Bhattacharyya Fed. Eur. Biochem. Soc. Lett., 218 (1), 102-106, (1987) Properties of B-ring analogues of colchicine

C21H22O9; aloin; barbaloin; CAS-No.: 1415-73-2; PubChem: CID 12305761
A. Retzow, W. Wiegrebe Scientia Pharmaceutica, 53, 209-221, (1985) Dithranol-Anion: UV/Vis-Spektrum und chemische Reaktivität

C23H22O7; rotenolone; 12a-hydroxyrotenone; CAS-No.: 509-96-6; PubChem: CID 68184
Z.C. Redman, J. Wesolowski, P.L. Tomco Environ. Sci. Technol., 55 (8), 4974-4983, (2021) Photochemical Pathways of Rotenone and Deguelin Degradation: Implications for Rotenoid Attenuation and Persistence in High-Latitude Lakes

C26H30O10; dehydrodiethylsinapate; DHDES; CAS-No.:
M.D. Horbury, M.A.P. Turner, J.S. Peters, M. Mention, A.L. Flourat, N.D.M. Hine, F. Allais, V.G. Stavros Front. Chem., 8, 633, (2020) Exploring the Photochemistry of an Ethyl Sinapate Dimer: An Attempt Toward a Better Ultraviolet Filter

C27H30O16; rutin; CAS-No.: 153-18-4
R.E. Stuckey J. Pharmacy Pharmacology, 4 (1), 345-365, (1952) The applications of ultra-violet absorption spectrophotometry in pharmaceutical analysis

G. Weiz, J.D. Breccia, L.S. Mazzaferro Food Chemistry, 229, 44-49, (2017) Screening and quantification of the enzymatic deglycosylation of the plant flavonoid rutin by UV-visible spectrometry

C27H42O3; diosgenin; CAS-No.: 512-04-9; PubChem: CID 99474
O.H. Wheeler, J.L. Mateos J. Org. Chem., 21 (10), 1110-1112, (1956) The Ultraviolet Absorption of Isolated Double Bonds

C27H42O5; dioctyl 4-methoxybenzylidenemalonate; DOMBM; CAS-No.: 
N. Oguchi-Fujiyama, K. Miyazawa, A. Kikuchi, M. Yagi Photochem. Photobiol. Sci., 11, 1528-1535, (2012) Photophysical properties of dioctyl 4-methoxybenzylidenemalonate: UV-B absorber

C27H44O; zymosterol; 5alpha-cholesta-8,24-dien-3beta-ol; CAS-No.: 128-33-6; PubChem: CID 92746
O.H. Wheeler, J.L. Mateos J. Org. Chem., 21 (10), 1110-1112, (1956) The Ultraviolet Absorption of Isolated Double Bonds

C27H44O2; 7-ketocholesterol; 7-oxocholesterol; CAS-No.: 566-28-9; PubChem: CID 91474
R.H. Cox, E.Y. Spencer Can. J. Chem., 29(5), 398-408, (1951) The ultraviolet absorption spectra of several dehydration and oxidation derivatives of cholesterol

C27H46O; allocholesterol; 3beta-hydroxycholest-4-ene; CAS-No.: 517-10-2
O.H. Wheeler, J.L. Mateos J. Org. Chem., 21 (10), 1110-1112, (1956) The Ultraviolet Absorption of Isolated Double Bonds

C27H46O; cholesterol; (3beta)-cholest-5-en-3-ol; CAS-No.: 57-88-5; PubChem: CID 5997
O.H. Wheeler, J.L. Mateos J. Org. Chem., 21 (10), 1110-1112, (1956) The Ultraviolet Absorption of Isolated Double Bonds

C28H18O6; 1,8,1',8'-tetrahydroxydianthron; 1,1',8,8'-tetrahydroxybisanthrone; CAS-No.: 31991-54-5; PubChem: CID
T.S. Melo, L. Dubertret, P. Prognon, A. Gond, G. Mahuzier, R. Santus J. Invest. Dermatology, 80 (1), 1-6, (1983) Physicochemical Properties and Stability of Anthralin in Model Systems and Human Skin

C29H20O2; 2,3,5,6-tetraphenyl-4H-pyran-4-one; 2,3,5,6-tetraphenyl-4-pyranone; CAS-No.: 14174-27-7; PubChem: CID 12841338
N. Ishibe, H. Sugimoto, J.B. Gallivan J. Chem. Soc., Faraday Trans. 2,71, 1812-1822, (1975) Electronic absorption and emission spectra of 4-pyrones, 4-thiopyrones and 4-pyridones

C29H48O; fucosterol; 3beta-hydroxy-5,24(28)-stigmastadiene; CAS-No.: 17605-67-3; PubChem: CID 5281328
O.H. Wheeler, J.L. Mateos J. Org. Chem., 21 (10), 1110-1112, (1956) The Ultraviolet Absorption of Isolated Double Bonds

C29H48O; stigmasterol; CAS-No.: 83-48-7; PubChem: CID 5280794
O.H. Wheeler, J.L. Mateos J. Org. Chem., 21 (10), 1110-1112, (1956) The Ultraviolet Absorption of Isolated Double Bonds

C29H50O; beta-sitosterol; stigmast-5-en-3-ol; CAS-No.: 83-46-5; PubChem: 222284
O.H. Wheeler, J.L. Mateos J. Org. Chem., 21 (10), 1110-1112, (1956) The Ultraviolet Absorption of Isolated Double Bonds

C30H30O8; gossypol; pogosin; CAS-No.: 303-45-7; PubChem: CID 3503
B. Marciniak, H. Kozubek, J. Koput, S. Paszyc Zeitschrift Naturforschung A, 45 (2), 179-183, (1990) Spectroscopic and Photochemical Studies of Gossypol in Solution

C30H48O3; oleanic acid; oleanolic acid; CAS-No.: 508-02-1; PubChem: CID 10494
O.H. Wheeler, J.L. Mateos J. Org. Chem., 21 (10), 1110-1112, (1956) The Ultraviolet Absorption of Isolated Double Bonds

C30H50O; lupeol; farganasterol; CAS-No.: 545-47-1; PubChem: CID 259846
O.H. Wheeler, J.L. Mateos J. Org. Chem., 21 (10), 1110-1112, (1956) The Ultraviolet Absorption of Isolated Double Bonds

C30H50O; beta-amyrin; amyrin; CAS-No.: 559-70-6; PubChem: CID 73145
O.H. Wheeler, J.L. Mateos J. Org. Chem., 21 (10), 1110-1112, (1956) The Ultraviolet Absorption of Isolated Double Bonds

C30H50O; ilexol; CAS-No.: 6466-94-0; PubChem: CID 287684
K. Yagishita Bull. Agricult. Chem. Soc. Japan, 22 (3), 131-136, (1958) The chemistry of ilexol. III. Isomerization of ilexol and its derivatives

C30H50O; iso-ilexol; CAS-No.: 
K. Yagishita Bull. Agricult. Chem. Soc. Japan, 22 (3), 131-136, (1958) The chemistry of ilexol. III. Isomerization of ilexol and its derivatives

C30H50O2; maniladiol; (3beta,16beta)-olean-12-ene-3,16-diol; CAS-No.: 595-17-5; PubChem: CID 12312726
O.H. Wheeler, J.L. Mateos J. Org. Chem., 21 (10), 1110-1112, (1956) The Ultraviolet Absorption of Isolated Double Bonds

C30H50O3; longispinogenin; CAS-No.: 465-94-1; PubChem: CID 12305723
O.H. Wheeler, J.L. Mateos J. Org. Chem., 21 (10), 1110-1112, (1956) The Ultraviolet Absorption of Isolated Double Bonds

C36H60O6; triisononyl trimellitate; tris(7-methyloctyl) benzene-1,2,4-tricarboxylate; CAS-No.: 53894-23-8; PubChem:
D. Vione, J.S. Arey, T.F. Parkerton, A.D. Redman Water Research, 121677, (2024) Direct and indirect photodegradation in aquatic systems mitigates photosensitized toxicity in screening-level substance risk assessments of selected petrochemical structures

C40H56O2; lutein; luteine; xanthophyll; CAS-No.: 127-40-2; PubChem: CID 6433159
H.K. Lichtenthaler, C. Buschmann Current Protocols in Food Analytical Chemistry, F4.3.1-F4.3.8 , (2001) Chlorophylls and Carotenoids: Measurement and Characterization by UV-VIS Spectroscopy

M. Kopczynski, T. Lenzer, K. Oum, J. Seehusen, M.T. Seidel, V.G. Ushakov Phys. Chem. Chem. Phys.,7, 2793-2803, (2005) Ultrafast transient lens spectroscopy of various C40 carotenoids: lycopene, beta-carotene, (3R,3'R)-zeaxanthin,  (3R,3'R,6'R)-lutein, echinenone, canthaxanthin, and astaxanthin

C40H56O2; (3R,3'R)-zeaxanthin; beta carotene 3,3' diol; zeaxanthin; CAS-No.: 144-68-3; PubChem: CID 5280899
M. Kopczynski, T. Lenzer, K. Oum, J. Seehusen, M.T. Seidel, V.G. Ushakov Phys. Chem. Chem. Phys.,7, 2793-2803, (2005) Ultrafast transient lens spectroscopy of various C40 carotenoids: lycopene, beta-carotene, (3R,3'R)-zeaxanthin,  (3R,3'R,6'R)-lutein, echinenone, canthaxanthin, and astaxanthin

C40H52O4; astaxanthin; 3,3'-dihydroxy-beta-carotene-4,4'-dione; CAS-No.: 472-61-7; PubChem: CID 5281224
M. Kopczynski, T. Lenzer, K. Oum, J. Seehusen, M.T. Seidel, V.G. Ushakov Phys. Chem. Chem. Phys.,7, 2793-2803, (2005) Ultrafast transient lens spectroscopy of various C40 carotenoids: lycopene, beta-carotene, (3R,3'R)-zeaxanthin,  (3R,3'R,6'R)-lutein, echinenone, canthaxanthin, and astaxanthin

C40H56O4; violaxanthin; zeaxanthin diepoxide; CAS-No.: 126-29-4; PubChem: CID 448438
H.K. Lichtenthaler, C. Buschmann Current Protocols in Food Analytical Chemistry, F4.3.1-F4.3.8 , (2001) Chlorophylls and Carotenoids: Measurement and Characterization by UV-VIS Spectroscopy

C40H56O5; vaucheriaxanthin; all-trans-vaucheriaxanthin; CAS-No.: 29789-80-8; PubChem: CID 102060377
M. Macernis, S. Streckaite, R. Litvin, A.A. Pascal, M.J. Llansola-Portoles, B. Robert, L. Valkunas J. Phys. Chem. A, 126, 6, 813–824, (2022) Electronic and Vibrational Properties of Allene Carotenoids