UV/Vis+ Photochemistry Database
Literature Service: Organic Carbonyl Compounds/Aldehydes/Ketones/Amides and related radicals
Substances (unsorted):
CHO, CH2O, HCDO, CD2O, CH3CO, CH3CHO, CH3CDO, CD3CHO, CD3CDO, HOCH2CHO, C3H2O, C4H4O, C2H5CHO, C3H7CHO, C4H9CHO, C5H11CHO, C6H6O2, C6H6O3, C6H10O, C6H12O, C8H16O, C6H13CHO, CH2CHCHO, CH3CH2CCHO, CH3CH=CHCHO, (CH3)2CHCHO, (CH3)2CHCH2CHO, CH3CH=C(CH3)CHO, C3H8O, (CH3)3CCHO, CH3COCH3, CD3C(O)CD3, CH3C(O)CH2Cl, CH3COCHO, CH3COC2H5, C4H8O2, C5H10O2, n-C3H7COCH3; C2H5COC2H5, C5H10O, CH3C(O)C(O)C2H5, C7H14O, ((CH3)2CH)2C(O), CH3C(O)CH2CH(CH3)2, CH3C(O)(CH)2CH(CH3)2, CHOCHO, CH2C(CH3)CHO, CH3C(O)CH2OH, CH3COCHCH2, C5H8O, (CH3)2NC(O)CH3, C4H4N2O, C6H8O, C6H10O, C6H12O, C8H8O, C9H8O, C9H10O, C10H10O, C10H12O, C10H14O, C10H16O, C3H4O2, C3H4O2, C3H6O3, C4H4O2, C4H6O, C4H6O2, C4H8O2, C5H6O, C5H6O2, C5H8O2, C6H12O2, C6H12O3, CH2CO, C5H4O2, C6H6O2, C7H6O2, C8H16O4, C9H6O2, C9H6O3, C9H6O4, C10H8O4, C7H8O2, C8H10O2, C10H16O2, C3H4O, C6H12O, C7H14O, C9H14O, C9H18O6, C12H10O, C15H10O
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.
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| Authors | Journal/Source | Title/Paper | Data Sheet |
|---|---|---|---|
| CHO; formyl radical; CAS-No.: 2597-44-6; PubChem: CID 123370 | |||
| G. Herzberg, D.A. Ramsey | Proceedings of the Royal Society of London. Series A, Mathematical and Physical Sciences, Volume 233, Issue 1192, pp. 34-54 | The 7500 to 4500 Angstrom Absorption System of the Free HCO Radical |
|
| C.J. Hochanadel, T.J. Sworski, P.J. Ogren | J. Phys. Chem., 84(3), 231-235, (1980) | Ultraviolet Spectrum and Reaction Kinetics of the Formyl Radical |
|
| J.E. Baggott, H.M. Frey, P.D. Lightfoot, R. Walsh | Chem. Phys. Lett., 132, 225-230, (1986) | The absorption cross section of the HCO radical at 614.59 nm and the rate constant for HCO + HCO --> H2CO + CO |
|
| D.B. Oh, A.C. Stanton, J.A. Silver | J. Phys. Chem., 97 (10), 2246-2250, (1993) | Measurement of formyl radical line strength in the A2A" <-- X2A' band system using visible/near-infrared diode laser absorption |
|
| Y. Tang, L. Zhu | J. Phys. Chem. A, 108 (40), 8307-8316, (2004) | Wavelength-Dependent Photolysis of n-Hexanal and n-Heptanal in the 280-330-nm Region |
|
| L.N. Krasnoperov, E.N. Chesnokov, H. Stark, A.R. Ravishankara | Proceedings of the Combustion Institute, 30, 935-943, (2005) | Elementary reactions of formyl (HCO) radical studied by laser photolysis-transient absorption spectroscopy |
|
| J.E. Flad, S.S. Brown, J.B. Burkholder, H. Stark, A.R. Ravishankara | Phys. Chem. Chem. Phys., 8, 3636 - 3642, (2006) | Absorption cross sections for the A2A" (0,90,0) <-- X2A' (0,01,0) band of the HCO radical |
|
| V.A. Shubert, S.T. Pratt | J. Phys. Chem. A, 114 (42), 11238-11243, (2010) | Photodissociation of Acetaldehyde and the Absolute Photoionization Cross Section of HCO |
|
| J.D. Savee, B. Sztaray, O. Welz, C.A. Taatjes, D.L. Osborn | J. Phys. Chem. A, 125 (18), 3874-3884, (2021) | Valence Photoionization and Autoionization of the Formyl Radical |
|
| CH2O; formaldehyde; methanal; CAS-No.: 50-00-0; PubChem: 712 | |||
| 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 |
|
| R.D. McQuigg, J.G. Calvert | J. Am. Chem. Soc., 91, 1590- 1599, (1969) | The Photodecomposition of CH2O, CD2O, CHDO, and CH2O-CD2O mixtures at xenon flash lamp intensities |
|
| J.E. Mentall, E.P. Gentieu, M. Krauss, D. Neumann | J. Chem. Phys., 55, 5471, (1971) | Photoionization and Absorption Spectrum of Formaldehyde in the Vacuum Ultraviolet |
|
| S. Glicker, L.J. Stief | J. Chem. Phys., 54, 2852-2857, (1971) | Photolysis of Formaldehyde at 1470 and 1236 A |
|
| J.G. Calvert, J.A. Kerr, K.L. Demerjan, R.D. McQuigg | Science, 175, 751-752, (1972) | Photolysis of Formaldehyd as a Hydrogen Atom Source in the Lower Stratosphere |
|
| H.P. Sperling, S. Toby | Can. J. Chem./Rev. can. chim. 51(4): 471-475, (1973) | The Photochemical Decomposition of Gaseous Formaldehyde |
|
| G.K. Moortgat | priv. comm., (1980) | MPI Mainz, 1980 |
|
| A.M. Bass | priv. comm., (1980) | (295 K) |
|
| A.M. Bass, L.C. Glasgow, C. Miller, J.P. Jesson, D.L. Filkin | Planet. Space Sci., 28, 675-679, (1980) | Temperature Dependent Absortion Cross Sections for Formaldehyde (CH2O): The Effect of Formaldehyde on Stratospheric Chlorine Chemistry |
|
| P. Brint, J.-P. Connerade, C. Mayhew, K. Sommer | J. Chem. Soc., Faraday Trans., 2, 81, 1643-1652, (1985) | The vacuum ultraviolet absorption spectrum of formaldehyde |
|
| G.K. Moortgat, W. Schneider | J. Phys. Chem. Ref. Data, 18, 1014, (1989) | (285 K) |
|
| C.A. Cantrell, J.A. Davidson, A.H. McDaniel, R.E. Shetter, J.G. Calvert | J. Phys. Chem., 94, 3902-3908, (1990) | Temperature-Dependent Formaldehyde Cross Sections in the Near-Ultraviolet Spectral Region |
|
| C.A. Cantrell, J.A. Davidson, A.H. McDaniel, R.E. Shetter, J.G. Calvert | J. Phys. Chem., 94, 3902-3908, (1990) | Temperature-Dependent Formaldehyde Cross Sections in the Near-Ultraviolet Spectral Region |
|
| J.D. Rogers | J. Phys. Chem., 94, 4011-4015, (1990) | Ultraviolet Absorption Cross Sections and Atmospheric Photodissociation Rate Constants of Formaldehyde |
|
| R. Meller | priv. comm., MPI Mainz, Germany, (1992) | UV spectrum of formaldehyde at 297 K |
|
| G. Cooper, J.E. Anderson, C.E. Brion | Chem. Phys., 209, 61-77, (1996) | Absolute photoabsorption and photoionization of formaldehyde in the VUV and soft X-ray regions (3–200 eV) |
|
| M.W. Mackey, J.W. Daily, J.T. McKinnon, E.P. Riedel | J. Photochem. Photobiol. A: Chemistry, 105, 1-6, (1997) | High-temperature UV-visible absorption spectral measurements and estimated primary photodissociation rates of formaldehyde, chlorobenzene and 1-chloronaphthalene |
|
| H. Barry, L. Corner, G. Hancock, R. Peverall, G.A.D. Ritchie | Phys. Chem. Chem. Phys., 4, 445 - 450, (2002) | Cross sections in the ny5 band of formaldehyde studied by cavity enhanced absorption spectroscopy near 1.76 micrometer |
|
| G. Friedrichs, D.F. Davidson, R.K. Hanson | Int. J. Chem. Kinet., 34, 374-386, (2002) | Direct measurements of the reaction H + CH2O --> H2 + HCO behind shock waves by means of vis-uv detection of formaldehyde |
|
| Y. Chen, L. Zhu | J. Phys. Chem. A, 107, 4643-4651, (2003) | Wavelength-dependent photolysis of glyoxal in the 290-420 nm region; (298 K) |
|
| Bai X., T. Metz, F. Ossler, M. Alden | Spectrochimica Acta, Part A 60, 821-828, (2004) | Absorption of formaldehyde (H2CO) in the A1A2<--X1A1 band system at elevated temperatures and pressures |
|
| M. Staak, E.W. Gash, D.S. Venables, A.A. Ruth | J. Molecular Spectroscopy, 229, 115-121, (2005) | The rotationally-resolved absorption spectrum of formaldehyde from 6547 to 6804 cm-1 |
|
| F.D. Pope, C.A. Smith, P.R. Davis, D.E. Shallcross, M.N.R. Ashfold, A.J. Orr-Ewing | Faraday Discuss., 130, 59-72, (2005) | Photochemistry of formaldehyde under tropospheric conditions |
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| F.D. Pope, C.A. Smith, M.N.R. Ashfold, A.J. Orr-Ewing | Phys. Chem. Chem. Phys., 7, 79 - 84, (2005) | High-resolution absorption cross sections of formaldehyde at wavelengths from 313 to 320 nm |
|
| D.T. Co, T.F. Hanisco, J.G. Anderson, F.N. Keutsch | J. Phys. Chem. A, 109 (47), 10675 -10682, (2005) | Rotationally Resolved Absorption Cross Sections of Formaldehyde in the 28100-28500 cm-1 (351-356 nm) Spectral Region: Implications for in Situ LIF Measurements |
|
| C.A. Smith, F.D. Pope, B. Cronin, C.B. Parkes, A.J. Orr-Ewing | J. Phys. Chem. A, 110 (41), 11645 -11653, (2006) | Absorption Cross Sections of Formaldehyde at Wavelengths from 300 to 340 nm at 294 and 245 K |
|
| Weixiong Zhao, Xiaoming Gao, Lunhua Deng, Teng Huang, Tao Wu, Weijun Zhang | J. Quant. Spectr. Rad. Transfer, 107, 331-339, (2007) | Absorption spectroscopy of formaldehyde at 1.573. micrometer |
|
| A. Gratien, B. Picquet-Varrault, J. Orphal, E. Perraudin, J.-F. Doussin, J.-M. Flaud | J. Geophys. Res., 112, D05305, (2007) | Laboratory intercomparison of the formaldehyde absorption cross sections in the infrared (1660–1820 cm-1) and ultraviolet (300–360 nm) spectral regions |
|
| A. Gratien, E. Nilsson, J.-F. Doussin, M.S. Johnson, C.J. Nielsen, Y. Stenstrom, B. Picquet-Varrault | J. Phys. Chem. A, 111 (45), 11506 -11513, (2007) | UV and IR Absorption Cross-sections of HCHO, HCDO, and DCDO |
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| T. Brauers, J. Bossmeyer, H.-P. Dorn, E. Schlosser, R. Tillmann, R. Wegener, A. Wahner | Atmos. Chem. Phys., 7, 3579-3586, (2007) | Investigation of the formaldehyde differential absorption cross section at high and low spectral resolution in the simulation chamber SAPHIR |
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| P.G. Carbajo, S.C. Smith, A.-L. Holloway, C.A. Smith, F.D. Pope, D.E. Shallcross, A.J. Orr-Ewing | J. Phys. Chem. A, 112 (48), 12437-12448, (2008) | Ultraviolet Photolysis of HCHO: Absolute HCO Quantum Yields by Direct Detection of the HCO Radical Photoproduct |
|
| M.B. Crow, A. Gilchrist, G. Hancock, R. Peverall, G. Richmond, G.A.D. Ritchie, S.R. Taylor | J. Phys. Chem. A, 113 (24), 6689-6696, (2009) | High-Resolution Absorption Studies of the 1A2 - 1A1 202401 Band of Formaldehyde |
|
| K. Sunanda, B.N. Rajasekhar, P. Saraswathy, B.N. Jagatap | Spectroscopy Letters, 45 (1), 65-73, (2012) | Photo-Absorption Studies on Formaldehyde Using Synchrotron Radiation at Indus I |
|
| C.T. Ernest, D. Bauer, A.J. Hynes | J. Phys. Chem. A, 116 (24), 5910-5922, (2012) | High-Resolution Absorption Cross Sections of Formaldehyde in the 30285-32890 cm-1 (304-330 nm) Spectral Region |
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| P. Morajkar, C. Schoemeacker, C. Fittschen | J. Mol. Spectroscopy, 281, 18-23, (2012) | Absolute absorption cross sections for two selected lines of formaldehyde around 6625 cm-1 |
|
| related data (quantum yield studies; photolysis studies, etc.) | |||
| K.B. Harvey, J.F. Ogilvie | Can. J. Chem., 40, 85-91, (1962) | Infrared absorption of formaldehyde at low temperatures, evidence for multiple trapping sites in an argon matrix |
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| M. Venugopalan, K.O. Kutschke | Can. J. Chem., 42, 2451-2455, (1964) | The photolysis of formaldehyde, formaldehyde-d2, and their mixtures |
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| A. Horowitz, J.G. Calvert | Int. J. Chem. Kinetics, 10, 805-819, (1978) | Wavelength dependence of the quantum efficiencies of the primary processes in formaldehyde photolysis at 25°C |
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| J.H. Clark, C.B. Moore, N.S. Nogar | J. Chem. Phys., 68, 1264-1272, (1978) | The photochemistry of formaldehyde: Absolute quantum yields, radical reactions, and NO reactions |
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| G.K. Moortgat, F. Slemr, W. Seiler, P. Warneck | Chem. Phys. Lett., 54, 444-447, (1978) | Photolysis of formaldehyde: Relative quantum yields of H2 and CO in the wavelength range 270–360 nm |
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| G.K. Moortgat, P. Warneck | J. Chem. Phys., 70, 3639-3651, (1979) | CO and H2 quantum yields in the photodecomposition of formaldehyde in air |
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| K.Y. Tang, P.W. Fairchild, E.K.C. Lee | J. Phys. Chem., 83, 569-573, (1979) | Laser-induced photodecomposition of formaldehyde (~A1A2) from its single vibronic levels. Determination of the quantum yield of H-atom by HNO (~A1A'') chemiluminescence |
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| G.K. Moortgat, W. Seiler, P. Warneck | J. Chem. Phys., 78, 1185-1190, (1983) | Photodissociation of HCHO in air: CO and H2 quantum yields at 220 and 300 K |
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| N.I. Sorokin, G.I. Skubnevskaya, N.M. Bazhin | Theoretical and Experimental Chemistry, 18 (4), 410-416, (1983) | Gas-phase photolysis of formaldehyde in the region of molecular dissociation |
|
| J. Desai, J. Heicklen | J. Photochemistry, 40, 23-29, (1987) | The wavelength dependence of the photo-oxidation of CH2O |
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| W.B. DeMore, S.P. Sander, D.M. Golden, R.F. Hampson, M.J. Kurylo, C.J. Howard, A.R. Ravishankara, C.E. Kolb, M.J. Molina | NASA, JPL publication 97-4, evaluation number 12, 166, (1997) | Chemical kinetics and photochemical data for use in stratospheric modeling |
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| G.D. Smith, L.T. Molina, M.J. Molina | J. Phys. Chem. A, 106 (7), 1233-1240, (2002) | Measurement of Radical Quantum Yields from Formaldehyde Photolysis between 269 and 339 nm |
|
| C.T. Ernest, D. Bauer, A.J. Hynes | J. Phys. Chem. A, 116 (26), 6983-6995, (2012) | Radical Quantum Yields from Formaldehyde Photolysis in the 30400-32890 cm-1 (304-329 nm) Spectral Region: Detection of Radical Photoproducts Using Pulsed Laser Photolysis-Pulsed Laser Induced Fluorescence |
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| HCDO; formaldehyde-d; CAS-No.: 1664-99-9 | |||
| A. Gratien, E. Nilsson, J.-F. Doussin, M.S. Johnson, C.J. Nielsen, Y. Stenstrom, B. Picquet-Varrault | J. Phys. Chem. A, 111 (45), 11506 -11513, (2007) | UV and IR Absorption Cross-sections of HCHO, HCDO, and DCDO |
|
| CD2O; formaldehyde-2d; CAS-No.: 1664-98-8 | |||
| S. Glicker, L.J. Stief | J. Chem. Phys., 54, 2852-2857 (1971) | Photolysis of formaldehyde at 1470 and 1236 Å |
|
| A. Gratien, E. Nilsson, J.-F. Doussin, M.S. Johnson, C.J. Nielsen, Y. Stenstrom, B. Picquet-Varrault | J. Phys. Chem. A, 111 (45), 11506 -11513, (2007) | UV and IR Absorption Cross-sections of HCHO, HCDO, and DCDO |
|
| related data (quantum yield studies; photolysis studies, etc.) | |||
| J.H. Clark, C.B. Moore, N.S. Nogar | J. Chem. Phys., 68, 1264-1272, (1978) | The photochemistry of formaldehyde: Absolute quantum yields, radical reactions, and NO reactions |
|
| C2H3O; CH3CO; acetyl radical; CAS-No.: 3170-69-2 | |||
| D.A. Parkes | Chem. Phys. Lett., 77, 527-532, (1981) | The ultraviolet absorption spectra of the acetyl radical and the kinetics of the CH3 + CO reaction at room temperature |
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| M.M. Maricq, J.J. Szente | Chem. Phys. Lett., 253, 333-339, (1996) | The UV spectrum of acetyl and the kinetics of the chain reaction between acetaldehyde and chlorine |
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| M. Cameron, V. Sivakumaran, T.J. Dillon, J.N. Crowley | Phys. Chem. Chem. Phys., 4, 3628 - 3638, (2002) | Reaction between OH and CH3CHO Part 1. Primary product yields of CH3(296 K), CH3CO (296 K), and H (237-296 K) |
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| B. Rajakumar, J.E. Flad, T. Gierczak, A.R. Ravishankara, J.B. Burkholder | J. Phys. Chem. A, 111 (37), 8950-8958, (2007) | Visible Absorption Spectrum of the CH3CO Radical |
|
| C2H4O; CH3CHO; acetaldehyde; ethanal; CAS-No.: 75-07-0; PubChem: CID 177 | |||
| J.W. Ellis | J. Am. Chem. Soc., 51, 1384-1394, (1929) | The near infrared absorption spectra of some aldehydes, ketones, esters and ethers |
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| A.D. Walsh | Proceedings of the Royal Society of London. A, Math. Phys. Sci.,185, 176-182, (1946) | The absorption spectrum of acetaldehyde in the vacuum ultra-violet |
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| J.S. Lake, A.J. Harrison | J. Chem. Phys., 30, 361, (1959) | Absorption of acyclic oxygen compounds in the vacuum ultraviolet. III. Acetone and acetaldehyde |
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| V. McMillan | John Wiley & Sons, London, p. 368, (1966) | Calvert and Pitts, Photochemistry |
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| G. Lucazeau, C. Sandorfy | J. Mol. Spectroscopy, 35, 214-231, (1970) | On the far-ultraviolet spectra of some simple aldehydes |
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| J. Weaver, J. Meagher, J. Heicklen | J. Photochemistry, 6, 111-126, (1976-1977) | Photo-oxidation of CH3CHO vapor at 3130 Å |
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| H. Meyrahn | PhD-Thesis, (1984) | University of Mainz, Germany, (298 K) |
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| M. Noble, K.C. Lee | J. Chem. Phys., 81, 1632-1642, (1984) | The jet-cooled electronic spectrum of acetaldehyde and deuterated derivatives at rotational resolution |
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| J.S. Crighton, S. Bell | J. Mol. Spectroscopy, 112 (2), 304-314, (1985) | Electronic spectrum of acetaldehyde: Vibrational analysis of the 182-nm system |
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| W. Schneider, G.K. Moortgat | priv. comm., (1989) | MPI Mainz, (294 K) |
|
| P. Brint, L. O'Toole, C.A. Mayhew, W. Dussa | J. Chem. Soc., Faraday Trans., 86, 3349 - 3354, (1990) | Vacuum-ultraviolet absorption spectrum of acetaldehyde, CH3CHO, and the related deuterides CH3CDO and CD3CDO |
|
| H.G. Libuda | Uni Wuppertal, Germany, (1992) | Spektroskopische und kinetische Untersuchungen an halogenierten Carbonylverbindungen von atmosphaerischem Interesse, Ph-D-Thesis |
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| R.D. Martinez, A.A. Buitrago, N.W. Howell, C.H. Hearn, J.A. Joens | Atmos. Env. A, 26, 785-792, (1992) | The near U.V. absorption spectra of several aliphatic aldehydes and ketones at 300 K |
|
| N.N. Yakovlev, I.A. Godunov | Can. J. Chem., 70, 931-934, (1992) | The a3A" <-- X1A' electronic spectra of acetaldehyde-h4 and -d4 |
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| H. Xu, P.J. Wentworth, N.W. Howell, J.A. Joens | Spectrochimica Acta Part A: Molecular Spectroscopy, 49, 1171-1178, (1993) | Temperature dependent near-UV molar absorptivities of aliphatic aldehydes and ketones in aqueous solution |
|
| P. Limao-Vieira, S. Eden, N.J. Mason, S.V. Hoffmann | Chem. Phys. Lett., 376, 737-747, (2003) | Electronic state spectroscopy of acetaldehyde, CH3CHO, by high-resolution VUV photo-absorption |
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| R. Locht | priv. comm., R. Locht, University of Liege, Belgium, (2020) | The Vacuum UV Photoabsorption Spectrum and HeI Photoelectron Spectrum of acetaldehyde |
|
| Y. Hashikawa, M. Kawasaki, R.L. Waterland, M.D. Hurley, J.C. Ball, T.J. Wallington, M.P. Sulbaek Andersen, O.J. Nielsen | J. Fluorine Chem., 125,1925–1932, (2004) | Gas phase UV and IR absorption spectra of CxF2x+1CHO (x = 1–4) |
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| R. Locht | priv. comm., University Liege, Belgium, (2021) | The Photoabsorption, HeI Photoelectron and Photoionization Spectra of Acetaldehyde |
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| 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 |
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| related data (quantum yield studies; photolysis studies, etc.) | |||
| F. Daniels | Third Report of the Committee on Photochemistry: Reprint and Circular Series of the National Research Council,Committee on Photochemistry; ISBN: 0-309-55909-X, pp 15-34, (1938) | A table of quantum yields in experimental photochemistry |
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| Y. Tang, L. Zhu, L.T. Chu, B. Xiang | Chem. Phys., 330, 155-165, (2006) | Cavity ring-down spectroscopic study of acetaldehyde photolysis in the gas phase, on aluminum surfaces, and on ice films |
|
| G.K. Moortgat, H. Meyrahn, P. Warneck | ChemPhysChem, 11 (18), 3896-3908, (2010) | Photolysis of Acetaldehyde in Air: CH4, CO and CO2 Quantum Yields |
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| C2H3DO; CH3CDO; acetaldehyde-d1; 1-deuteroacetaldehyde; CAS-No.: 4122-13-8 | |||
| G. Lucazeau, C. Sandorfy | J. Mol. Spectr., 35 (2), 214-231, (1970) | On the far-ultraviolet spectra of some simple aldehydes |
|
| C2HD3O; CD3CHO; acetaldehyde-2,2,2-d3; 2,2,2-trideuterioacetaldehyde; CAS-No.: 19901-15-6; PubChem: CID 140625 | |||
| G. Lucazeau, C. Sandorfy | J. Mol. Spectr., 35 (2), 214-231, (1970) | On the far-ultraviolet spectra of some simple aldehydes |
|
| C2D4O; CD3CDO; acetaldehyde-d4; tetradeuteroacetaldehyde; CAS-No.: 1632-89-9 | |||
| G. Lucazeau, C. Sandorfy | J. Mol. Spectr., 35 (2), 214-231, (1970) | On the far-ultraviolet spectra of some simple aldehydes |
|
| N.N. Yakovlev, I.A. Godunov | Can. J. Chem., 70, 931-934, (1992) | The a3A" <-- X1A' electronic spectra of acetaldehyde-h4 and -d4 |
|
| C2H4O2; HOCH2CHO; glycolaldehyde; acetaldehyde, hydroxy-; CAS-No.: 141-46-8 | |||
| A. Beeby, D. bin H Mohammed, J.R. Sodeau | J. Am. Chem. Soc., 109 (3), 857-861, (1987) | Photochemistry and photophysics of glycolaldehyde in solution |
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| C. Bacher, G.S. Tyndall, J.J. Orlando | J. Atmos. Chem., 39, 171-189, (2001) | The atmosperic chemistry of glycolaldehyde |
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| I. Magneron, A. Mellouki, G. Le Bras, G.K. Moortgat, A. Horowitz, K. Wirtz | J. Phys. Chem. A, 109 (20), 4552-4561, (2005) | Photolysis and OH-Initiated Oxidation of Glycolaldehyde under Atmospheric Conditions |
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| R. Karunanandan, D. Hölscher, T.J. Dillon, A. Horowitz, J.N. Crowley, L. Vereecken, J. Peeters | J. Phys. Chem. A, 111 (5), 897-908, (2007) | Reaction of HO with Glycolaldehyde, HOCH2CHO: Rate Coefficients (240-362 K) and Mechanism |
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| C. Zhu, L. Zhu | J. Phys. Chem. A, 114 (32), 8384-8390, (2010) | Photolysis of Glycolaldehyde in the 280-340 nm Region |
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| C3H2O; propargyl aldehyde; 2-propynal; propiolaldehyde; CAS-No.: 624-67-9; PubChem: 12222 | |||
| J.A. Howe, J.H. Goldstein | J. Am. Chem. Soc., 80 (18), 4846-4849, (1958) | The near ultraviolet absorption spectrum of propargyl aldehyde |
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| C3H6O; C2H5CHO; propionaldehyde; propanal; CAS-No.: 123-38-6 | |||
| J.W. Ellis | J. Am. Chem. Soc., 51, 1384-1394, (1929) | The near infrared absorption spectra of some aldehydes, ketones, esters and ethers |
|
| F.E. Blacet, R.A. Crane | J. Am. Chem. Soc., 76(21), 5337-5340, (1954) | The Photolysis of the Aliphatic Aldehydes. XVII. Propionaldehyde, n-Butyraldehyde and Isobutyraldehyde at 2380 and 1870 A |
|
| V. McMillan | John Wiley & Sons, London, p. 368, (1966) | Calvert and Pitts, Photochemistry |
|
| G. Lucazeau, C. Sandorfy | J. Mol. Spectr., 35 (2), 214-231, (1970) | On the far-ultraviolet spectra of some simple aldehydes |
|
| R.D. Martinez, A.A. Buitrago, N.W. Howell, C.H. Hearn, J.A. Joens | Atmos. Env. A, 26, 785-792, (1992) | The near U.V. absorption spectra of several aliphatic aldehydes and ketones at 300 K |
|
| H. Xu, P.J. Wentworth, N.W. Howell, J.A. Joens | Spectrochimica Acta Part A: Molecular Spectroscopy, 49, 1171-1178, (1993) | Temperature dependent near-UV molar absorptivities of aliphatic aldehydes and ketones in aqueous solution |
|
| N.C. Shand, C.-L. Ning, M.R.F. Siggel, I.C. Walker, J. Pfab | J. Chem. Soc., Faraday T rans., 93(16), 2883-2888, (1997) | One- and two-photon spectroscopy of the 3s <-- n Rydberg transition of propionaldehyde (propanal) |
|
| Y. Chen, L. Zhu | J. Phys. Chem. A, 105, 9689-9696, (2001) | The Wavelength dependence of the photodissociation of propionaldehyde in the 280-330 nm region |
|
| J.-H. Xing, M. Ono, A. Kuroda, K. Obi, K. Sato, T. Imamura | J. Phys. Chem. A, 116 (33), 8523-8529, (2012) | Kinetic Study of the Daytime Atmospheric Fate of (Z)-3-Hexenal |
|
| related data (quantum yield studies; photolysis studies, etc.) | |||
| J. Heicklen, J. Desai, A. Bahta, C. Harper, R. Simonaitis | J. Photochem., 34, 117-135, (1986) | The temperature and wavelength dependence of the photo-oxidation of propionaldehyde |
|
| C4H4O; 2-butynal; tetrolaldehyde; CAS-No.: 1119-19-3; PubChem: CID 136875 | |||
| J.S. Muirhead, J.A. Howe | J. Chem. Phys., 36, 2316-2319, (1962) | Near-Ultraviolet Absorption Spectrum of Tetrolaldehyde |
|
| C4H8O; C3H7CHO; n-butyraldehyde; butanal; CAS-No.: 123-72-8; PubChem: CID 261 | |||
| J.W. Ellis | J. Am. Chem. Soc., 51, 1384-1394, (1929) | The near infrared absorption spectra of some aldehydes, ketones, esters and ethers |
|
| F.E. Blacet, R.A. Crane | J. Am. Chem. Soc., 76, 5337-5340, (1954) | The photolysis ot the aliphatic aldehydes. XVII. Propionaldehyde, n-butyraldehyde, and isobutyraldehyde at 2380 and 1870 A |
|
| R.P. Borkowski, P. Ausloos | J. Am. Chem. Soc., 84, 4044-4048, (1962) | The vapor phase fluorescence and its relationship to the photolysis of propionaldehyde and the butyraldehydes |
|
| G. Lucazeau, C. Sandorfy | J. Mol. Spectr., 35 (2), 214-231, (1970) | On the far-ultraviolet spectra of some simple aldehydes |
|
| R.D. Martinez, A.A. Buitrago, N.W. Howell, C.H. Hearn, J.A. Joens | Atmospheric Environment A, 26, 785-792, (1992) | The near U.V. absorption spectra of several aliphatic aldehydes and ketones at 300 K |
|
| H. Xu, P.J. Wentworth, N.W. Howell, J.A. Joens | Spectrochimica Acta Part A: Molecular Spectroscopy, 49, 1171-1178, (1993) | Temperature dependent near-UV molar absorptivities of aliphatic aldehydes and ketones in aqueous solution |
|
| J. Tadic, I. Juranic, G.K. Moortgat | J. Photochem. Photobiol. A: Chemistry, 143, 169-179, (2001) | Pressure dependence of the photooxidation of selected carbonyl compounds in air: n-butanal and n-pentanal |
|
| Y. Chen, L. Zhu, J.S. Francisco | J. Phys. Chem. A, 106, 7755-7763, (2002) | Wavelength-dependent photolysis of n-butyraldehyde and i-butyraldehyde in the 280-330 nm region |
|
| 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, 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 |
|
| C5H10O; C4H9CHO; n-pentanal; n-valeraldehyde; CAS-No.: 110-62-3 | |||
| Y.Y. Sham, J.A. Joens | Spectrochimica Acta, 51A, 247-251, (1995) | Temperature dependent near UV molar absorptivities of several small aldehydes in aqueous solution |
|
| T. Cronin, L. Zhu | J. Phys. Chem. A, 102, 10274-10279, (1998) | Dye laser photolysis of n-pentanal from 280 to 330 nm |
|
| J. Tadic, I. Juranic, G.K. Moortgat | J. Photochem. Photobiol. A: Chem., 143, 169-179, (2001) | Pressure dependence of the photooxidation of selected carbonyl compounds in air: n-butanal and n-pentanal |
|
| C6H12O; C5H11CHO; hexanal; hexanaldehyde; CAS-No.: 66-25-1 | |||
| Y.Y. Sham, J.A. Joens | Spectrochimica Acta, 51A, 247-251, (1995) | Temperature dependent near UV molar absorptivities of several small aldehydes in aqueous solution |
|
| H. Plagens | Ph-D Thesis, University of Wuppertal, Germany, (2001) | Untersuchung zum atmosphärenchemischen Abbau langkettiger Aldehyde |
|
| Y. Tang, L. Zhu | J. Phys. Chem. A, 108 (40), 8307 -8316, (2004) | Wavelength-Dependent Photolysis of n-Hexanal and n-Heptanal in the 280-330-nm Region |
|
| M.P. O'Connor, J.C. Wenger, A. Mellouki, K. Wirtz, A. Munoz | Phys. Chem. Chem. Phys., 8, 5236-5246, (2006) | The atmospheric photolysis of E-2-hexenal, Z-3-hexenal and E,E-2,4-hexadienal |
|
| E. Jimenez, B. Lanza, E. Martinez, J. Albaladejo | Atmos. Chem. Phys., 7, 1565–1574, (2007) | Daytime tropospheric loss of hexanal and trans-2-hexenal: OH kinetics and UV photolysis |
|
| related data (quantum yield studies; photolysis studies, etc.) | |||
| J. Tadic, I. Juranic, G.K. Moortgat | Molecules, 6, 287-299, (2001) | Photooxidation of n-Hexanal in Air |
|
| C6H10O; cis-3-hexenal; (Z)-3-Hexenal; CAS-No.: 6789-80-6 | |||
| J.-H. Xing, M. Ono, A. Kuroda, K. Obi, K. Sato, T. Imamura | J. Phys. Chem. A, 116 (33), 8523-8529,(2012) | Kinetic Study of the Daytime Atmospheric Fate of (Z)-3-Hexenal |
|
| C6H10O; trans-2-hexenal, 2-hexenal; (E)-hex-2-enal; CAS-No.: 6728-26-3; PubChem: CID 5281168 | |||
| E. Jimenez, B. Lanza, E. Martinez, J. Albaladejo | Atmos. Chem. Phys., 7, 1565–1574, (2007) | Daytime tropospheric loss of hexanal and trans-2-hexenal: OH kinetics and UV photolysis |
|
| C. Kalalian, B. Samir, E. Roth, A. Chakir | Chem. Phys. Lett., 718, 22-26, (2019) | UV absorption spectra of trans-2-pentenal, trans-2-hexenal and 2-methyl-2pentenal |
|
| C6H10O; 2-methyl-2pentenal; (E)-2-methyl-2-pentenal; 2-methyl-3-ethylacrolein; CAS-No.: 623-36-9; PubChem: CID 5319754 | |||
| C. Kalalian, B. Samir, E. Roth, A. Chakir | Chem. Phys. Lett., 718, 22-26, (2019) | UV absorption spectra of trans-2-pentenal, trans-2-hexenal and 2-methyl-2pentenal |
|
| C8H16O; 2-ethyl hexanal; CAS-No.: 123-05-7 | |||
| J.C. Fraire, G.A. Argüello, F.E. Malanca | J. Photochem. Photobiol. A: Chem., 223, 165-171, (2011) | Atmosperic chemistry of 2-ethyl hexanal: Photochemistry and oxidation in the presence of NO2 |
|
| C7H14O; C6H13CHO; heptanal; heptaldehyde; CAS-No.:111-71-7; PubChem: CID 8130 | |||
| H. Plagens | Ph-D Thesis, University of Wuppertal, Germany, (2001) | Untersuchung zum atmosphärenchemischen Abbau langkettiger Aldehyde |
|
| Y. Tang, L. Zhu | J. Phys. Chem. A, 108 (40), 8307 -8316, (2004) | Wavelength-Dependent Photolysis of n-Hexanal and n-Heptanal in the 280-330-nm Region |
|
| related data (quantum yield studies; photolysis studies, etc.) | |||
| J.M. Tadic, I.O. Juranic, G.K. Moortgat | J. Chem. Soc., Perkin Trans. 2, 135-140, (2002) | Photooxidation of n-heptanal in air: Norrish type I and II processes and quantum yield total pressure dependency |
|
| S.E. Paulson, D.-L. Liu, G.E. Orzechowska, L.M. Campos, K.N. Houk | J. Org. Chem., 71, 17, 6403–6408, (2006) | Photolysis of Heptanal |
|
| C3H4O; CH2CHCHO; acrolein; 2-propenal; CAS-No.: 107-02-8; PubChem: CID 7847 | |||
| A.D. Walsh | Trans. Faraday Soc., 41, 498 - 505, (1945) | The absorption spectra of acrolein, crotonaldehyde and mesityl oxide in the vacuum ultra-violet |
|
| Y.Y. Sham, J.A. Joens | Spectrochimica Acta, 51A, 247-251, (1995) | Temperature dependent near UV molar absorptivities of several small aldehydes in aqueous solution |
|
| I. Magneron, R. Thévenet, A. Mellouki, G. Le Bras, G.K. Moortgat, K. Wirtz | J. Phys. Chem. A, 106 (11), 2526 -2537, (2002) | A Study of the Photolysis and OH-initiated Oxidation of Acrolein and trans-Crotonaldehyde |
|
| A.M.D. Lee, J.D. Coe, S. Ullrich, M.-L. Ho, S.-J. Lee, B.-M. Cheng, M.Z. Zgierski, I.-C. Chen, T.J. Martinez, A. Stolow | J. Phys. Chem. A, 111 (47), 11948 -11960, (2007) | Substituent Effects on Dynamics at Conical Intersections: alpha, beta-Enones |
|
| F. Goulay, A.J. Trevitt, J.D. Savee, J. Bouwman, D.L. Osborn, C.A. Taatjes, K.R. Wilson, S.R. Leone | J. Phys. Chem. A, 116 (24), 6091-6106, (2012) | Product Detection of the CH Radical Reaction with Acetaldehyde |
|
| 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 |
|
| related data (quantum yield studies; photolysis studies, etc.) | |||
| B.-M. Haas, T.K. Minton, P. Felder, J.R. Huber | J. Phys. Chem., 95, 5149-5159, (1991) | Photodissociation of acrolein and propynal at 193 nm in a molecular beam. Primary and secondary reactions |
|
| C4H6O; CH3CH2CCHO; methacrolein; 2-methyl-2-propenal; CAS-No.: 78-85-3 | |||
| R. Meller | priv. comm., (1990) | MPI Mainz, (294 K) |
|
| A.M.D. Lee, J.D. Coe, S. Ullrich, M.-L. Ho, S.-J. Lee, B.-M. Cheng, M.Z. Zgierski, I.-C. Chen, T.J. Martinez, A. Stolow | J. Phys. Chem. A, 111 (47), 11948 -11960, (2007) | Substituent Effects on Dynamics at Conical Intersections: alpha, beta-Enones |
|
| F. Xiong, C.H. Borca, L.V. Slipchenko, P.B. Shepson | Atmos. Chem. Phys., 16, 5595-5610, (2016) | Photochemical degradation of isoprene-derived 4,1-nitrooxy enal |
|
| C4H6O; CH3CH=CHCHO; crotonaldehyde; trans-2-butenal; CAS-No.: 123-73-9; PubChem: CID 643789 | |||
| A.M.D. Lee, J.D. Coe, S. Ullrich, M.-L. Ho, S.-J. Lee, B.-M. Cheng, M.Z. Zgierski, I.-C. Chen, T.J. Martinez, A. Stolow | J. Phys. Chem. A, 111 (47), 11948 -11960, (2007) | Substituent Effects on Dynamics at Conical Intersections: alpha, beta-Enones |
|
| 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, 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; (CH3)2CHCHO; 2-methylpropanal; isobutyraldehyde; isobutanal; CAS-No.: 78-84-2; PubChem: CID 6561 | |||
| G. Lucazeau, C. Sandorfy | J. Mol. Spectr., 35 (2), 214-231, (1970) | On the far-ultraviolet spectra of some simple aldehydes |
|
| Y.Y. Sham, J.A. Joens | Spectrochimica Acta, 51A, 247-251, (1995) | Temperature dependent near UV molar absorptivities of several small aldehydes in aqueous solution |
|
| Y. Chen, L. Zhu, J.S. Francisco | J. Phys. Chem. A, 106, 7755-7763, (2002) | Wavelength-dependent photolysis of n-butyraldehyde and i-butyraldehyde in the 280-330 nm region |
|
| 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 |
|
| C5H10O; (CH3)2CHCH2CHO; isopentanal; 3-methylbutanal; isovaleraldehyde; isovaleral; CAS-No.: 590-86-3; PubChem: CID 11552 | |||
| L. Zhu, T. Cronin, A. Narang | J. Phys. Chem. A, 103, 7248-7253, (1999) | Wavelength-dependent photolysis of i-pentanal and t-pentanal from 280-330 nm region |
|
| B. Lanza, E. Jimenez, B. Ballesteros, J. Albaladejo | Chem. Phys. Lett., 454, 184–189, (2008) | Absorption cross section determination of biogenic C5-aldehydes in the actinic region |
|
| 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 |
|
| C5H7O; (CH3)3CCHO; t-pentanal; 2,2-dimethylpropanal; CAS-No.: 630-19-3 | |||
| L. Zhu, T. Cronin, A. Narang | J. Phys. Chem. A, 103, 7248-7253, (1999) | Wavelength-dependent photolysis of i-pentanal and t-pentanal from 280-330 nm region |
|
| C5H8O; CH3CH=C(CH3)CHO; trans-2-methyl-2-butenal; CAS-No.: 497-03-0 | |||
| B. Lanza, E. Jimenez, B. Ballesteros, J. Albaladejo | Chem. Phys. Lett., 454, 184–189, (2008) | Absorption cross section determination of biogenic C5-aldehydes in the actinic region |
|
| C5H8O; 3-methyl-2-butenal; 3-methylbut-2-enal; CAS-No.: 107-86-8; PubChem: CID 61020 | |||
| B. Lanza, E. Jimenez, B. Ballesteros, J. Albaladejo | Chem. Phys. Lett., 454, 184–189, (2008) | Absorption cross section determination of biogenic C5-aldehydes in the actinic region |
|
| 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 |
|
| C5H8O; trans-2-pentenal; 2-pentenal; 3-ethylacrolein; CAS-No.: 1576-87-0; PubChem: CID 5364752 | |||
| C. Kalalian, B. Samir, E. Roth, A. Chakir | Chem. Phys. Lett., 718, 22-26, (2019) | UV absorption spectra of trans-2-pentenal, trans-2-hexenal and 2-methyl-2pentenal |
|
| C6H6O2; HCOCH=CHCH=CHCHO(E,E); E,E-2,4-hexadienedial; (E,E)-muconaldehyde; CAS-No.: 18409-46-6 | |||
| B. Xiang, L. Zhu | Chem. Phys. Lett., 450, 31-38, (2007) | Absorption cross sections of E,E-2,4-hexadienedial at 248 nm, and in the 290–430 nm region, and photolysis study at 248, 308, and 351 nm |
|
| C6H6O3; 5-hydroxymethylfurfural; 5-hydroxymethyl-2-furaldehyde; HMF; CAS-No.: 67-47-0; PubChem: CID 237332 | |||
| T. Psarras, J.W. Tefteller, H.K. Zimmerman | Recueil des Travaux Chimiques des Pays-Bas, 80 (2), 232-236, (1961) | Ultraviolet absorption spectra of 1-furfural and of 5-hydroxymethyl-furfural in aqueous buffers |
|
| C3H4O2; CH3COCHO; methylglyoxal; pyruvaldehyde; CAS-No.: 78-98-8 | |||
| E. Kyle, S.W. Orchard | J. Photochem., 7, 305-317, (1977) | The photolysis of methyl glyoxal vapour at 436 nm |
|
| C.N. Plum, R. Atkinson, W.P.L. Carter, J.N. Pitts, Jr. | Environ. Sci. Technol., 17, 479-484, (1983) | OH Radical Rate Constants and Photolysis Rates of a-Dicarbonyls |
|
| R. Meller, W. Raber, J.N. Crowley, M.E. Jenkin, G.K. Moortgat | J. Photochem. Photobiol. A: Chem., 62, 163-171, (1991) | The UV-Visible Absorption Spectrum of Methylglyoxal |
|
| T.A. Staffelbach, J.J. Orlando, G.S. Tyndall, J.G. Calvert | J. Geophys. Res., 100, 14189-14198, (1995) | The UV-Visible Absorption Spectrum and Photolysis Quantum Yields of Methylglyoxal |
|
| Y. Chen, W. Wang, L. Zhu | J. Phys. Chem. A, 104, 11126-11131, (2000) | Wavelength-dependent photolysis of methylglyoxal in the 290-440 nm region |
|
| C3H6O; CH3C(O)CH3; acetone; dimethyl ketone; propanone; CAS-No.: 67-64-1; PubChem: CID 180 | |||
| W.A. Noyes, A.B.F. Duncan, W.M. Manning | J. Chem. Phys., 2, 717-725, (1934) | Photochemical Studies. XIX The Ultraviolet Absorption Spectrum of Acetone Vapor |
|
| A.B.F. Duncan | J. Chem. Phys., 3, 131-132, (1935) | The absorption spectrum of acetone vapor in the far ultraviolet |
|
| W.A. Noyes Jr., G.B. Porter, J.E. Jolley | Chem. Rev., 56 (1), 49-94, (1956) | The Primary Photochemical Process In Simple Ketones |
|
| J.S. Lake, A.J. Harrison | J. Chem. Phys., 30, 361-362, (1959) | Absorption of acyclic oxygen compounds in the vacuum ultraviolet. III. Acetone and acetaldehyde |
|
| V. McMillan | John Wiley & Sons, London, p. 377, (1966) | Calvert and Pitts, Photochemistry |
|
| I.S. Pominov, A.A. Navlova | J. Applied Spectroscopy, 9 (1), 700-702, (1968) | Effect of temperature and salts on the UV absorption spectra of acetone and methylethylketone |
|
| H. Ito, Y. Nogata, S. Matsuzaki, A. Kuboyama | Bull. Chem. Soc. Japan, 42, 2453-2458, (1969) | Vacuum-ultraviolet Absorption Spectra of Aliphatic Ketones |
|
| H. Meyrahn, J. Pauly, W Schneider, P. Warneck | J. Atmos. Chem., 4, 277-291, (1986) | Quantum Yields for the Photodissociation of Acetone in Air and an Estimate for the Life Time of Acetone in the Lower Troposphere |
|
| W. Schneider, G.K. Moortgat | priv. comm., (1987) | MPI Mainz, 1987 |
|
| W. Braun, R. Klein, A. Fahr, H. Okabe, A. Mele | Chem. Phys. Lett., 166, 397-403, (1990) | Laser photolysis of trimethylgallium at 193 nm: Quantum yields for methyl radical and ethane production |
|
| R.D. Martinez, A.A. Buitrago, N.W. Howell, C.H. Hearn, J.A. Joens | Atmos. Environment, Part A, 26 (5), 785-792, (1992) | The near U.V. absorption spectra of several aliphatic aldehydes and ketones at 300 K |
|
| R. Kamps, H. Mueller, M. Schmitt, S. Sommer, Z. Wang, K. Kleinermanns | Chemosphere, 27 (11), 2127-2142, (1993) | Photooxidation of exhaust pollutants: I. Degradation efficiencies, quantum yields and products of benzene photooxidation |
|
| H. Xu, P.J. Wentworth, N.W. Howell, J.A. Joens | Spectrochimica Acta Part A: Molecular Spectroscopy, 49, 1171-1178, (1993) | Temperature dependent near-UV molar absorptivities of aliphatic aldehydes and ketones in aqueous solution |
|
| T. Gierczak, J.B. Burkholder, S. Bauerle, A.R. Ravishankara | Chem. Phys., 231, 229-244, (1998) | Photochemisty of acetone under atmospheric conditions |
|
| M. Wollenhaupt, S.A. Carl, A. Horowitz, J.N. Crowley | J. Phys. Chem. A, 104 (12), 2695 -2705, (2000) | Rate Coefficients for Reaction of OH with Acetone between 202 and 395 K |
|
| M. Yujing, A. Mellouki | J. Photochem. Photobiol. A: Chemistry, 134, 31-36, (2000) | The near-UV absorption cross sections for several ketones |
|
| F. Jorand, L. Kerhoas, A. Heiss, J. Einhorn, K. Sahetchian | J. Photochem. Photobiol. A: Chem., 134, 119-125, (2000) | Determination of the ultraviolet absorption cross section of hexyl-ketohydroperoxides in solution in acetonitrile |
|
| C. Wang, S.T. Scherrer, D. Hossain | Applied Spectroscopy, 58, Number 7, 784-791, (2004) | Measurements of Cavity Ringdown Spectroscopy of Acetone in the Ultraviolet and Near-Infrared Spectral Regions: Potential for Development of a Breath Analyzer |
|
| V. Feigenbrugel, C. Loew, S. Le Calve, P. Mirabel | J. Photochemistry and Photobiology A: Chemistry, 174, 76-81, (2005) | Near-UV molar absorptivities of acetone, alachlor, metolachlor, diazinon and dichlorvos in aqueous solution |
|
| J.D. Koch, J. Gronki, R.K. Hanson | J. Quant. Spectr. Rad. Transfer, 109, 2037-2044, (2008) | Measurements of near-UV absorption spectra of acetone and 3-pentanone at high temperatures |
|
| M. Nobre, A. Fernandes, F. Ferreira da Silva, R. Antunes, D. Almeida, V. Kokhan, S.V. Hoffmann, N.J. Mason, S. Eden, P. Limão-Vieira | Phys. Chem. Chem. Phys., 10, 550 - 560, (2008) | The VUV electronic spectroscopy of acetone studied by synchrotron radiation |
|
| J. Chen, D.S. Venables | Atmos. Meas. Tech., 4, 425-436, (2011) | A broadband optical cavity spectrometer for measuring weak near-ultraviolet absorption spectra of gases |
|
| W. Denzel, G. Hancock, M. Islam, C.E. Langley, R. Peverall, G.A.D. Ritchie, D. Taylor | Analyst,136, 801-806, (2011) | Trace species detection in the near infrared using Fourier transform broadband cavity enhanced absorption spectroscopy: initial studies on potential breath analytes |
|
| A. Shastri, P. Jeet Singh, B.N. Raja Sekhar, R. D’Souza, B.N. Jagatap | J. Quant. Spectr. Rad. Transfer, 113 (12), 1553-1565, (2012) | The Role of Torsional Modes in the Electronic Absorption Spectrum of Acetone |
|
| M. Sangwan, E.N. Chesnokov, L.N. Krasnoperov | J. Phys. Chem. A, 116 (34), 8661-8670, (2012) | Reaction CH3 + OH Studied over the 294-714 K Temperature and 1-100 bar Pressure Ranges |
|
| Y. Ren, F. Bernard, V. Daele, A. Mellouki | Env. Sci. Tech., 53 (15), 8862-8871, (2019) | Atmospheric Fate and Impact of Perfluorinated Butanone and Pentanone |
|
| 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 |
|
| related data (quantum yield studies; photolysis studies, etc.) | |||
| L. Ju-Te Lin, P. Ausloos | J. Photochem., 1, 453-462, (1972-1973) | Gas phase photolysis of acetone in the far ultra-violet |
|
| A. Horowitz | J. Phys. Chem., 95 (26), 10816-10823, (1991) | Wavelength dependence of the primary photodissociation processes in acetone photolysis |
|
| T. Gierczak, J.B. Burkholder, S. Bauerle, A.R. Ravishankara | Chem. Phys., 231, 229-244, (1998) | Photochemistry of acetone under tropospheric conditions |
|
| M. Emrich, P. Warneck | J. Phys. Chem. A, 104 (42), 9436 -9442, (2000) | Photodissociation of Acetone in Air: Dependence on Pressure and Wavelength. Behavior of the Excited Singlet State |
|
| S. Aloisio, J.S. Francisco | Chem. Phys. Lett., 329, 179-184, (2000) | The photochemistry of acetone in the presence of water |
|
| K. Takahashi, T. Nakayama,Y. Matsumi, Y. Osamura | J. Phys. Chem. A, 108 (39), 8002 -8008, (2004) | Hydrogen Atom Formation in the Photolysis of Acetone at 193 nm |
|
| M.A. Blitz, D.E. Heard, M.J. Pilling, S.R. Arnold, M.P. Chipperfield | Geophys. Res. Lett., 31, (2004) | Pressure and temperature-dependent quantum yields for the photodissociation of acetone between 279 and 327.5 nm |
|
| S.R. Arnold, M.P. Chipperfield, M.A. Blitz, D.E. Heard, M.J. Pilling | Geophys. Res. Lett., 31, (2004) | Photodissociation of acetone: Atmospheric implications of temperature-dependent quantum yields |
|
| H. Somnitz, M. Fida, T. Ufer, R. Zellner | Phys. Chem. Chem. Phys., 7, 3342 - 3352, (2005) | Pressure dependence for the CO quantum yield in the photolysis of acetone at 248 nm: A combined experimental and theoretical study |
|
| M.A. Blitz, D.E. Heard, M.J. Pilling | J. Phys. Chem. A, 110 (21), 6742 -6756, (2006) | Study of Acetone Photodissociation over the Wavelength Range 248-330 nm: Evidence of a Mechanism Involving Both the Singlet and Triplet Excited States |
|
| R. Nadasdi, G. Kovacs, I. Szilagyi, A. Demeter, S. Dobe, T. Berces, F. Marta | Chem. Phys. Lett., 440, 31-35, (2007) | Exciplex laser photolysis study of acetone with relevance to tropospheric chemistry |
|
| V. Khamaganov, R. Karunanandan, A. Rodriguez, J.N. Crowley | Phys. Chem. Chem. Phys., 9, 4098-4113, (2007) | Photolysis of CH3C(O)CH3 (248 nm, 266 nm), CH3C(O)C2H5 (248 nm) and CH3C(O)Br (248 nm): pressure dependent quantum yields of CH3 formation |
|
| B. Rajakumar, T. Gierczak, J. Flad, A.R. Ravishankara, J.B. Burkholder | J. Photochem. Photobiol. A: Chem., 199, 336-344, (2008) | The CH3CO quantum yield in the 248 nm photolysis of acetone, methyl ethyl ketone, and biacetyl |
|
| I. Szilágyi, G. Kovács, M. Farkas, G. L. Zügner, A. Gola, S. Dóbé, A. Demeter | Reaction Kinetics and Catalysis Letters, 96 (2), 437-446, (2009) | Photochemical and photophysical study on the kinetics of the atmospheric photodissociation of acetone |
|
| V.G. Khamaganov, R. Karunanandan, A. Horowitz, T.J. Dillon, J.N. Crowley | Phys. Chem. Chem. Phys., 11, 6173 - 6181, (2009) | Photolysis of CH3C(O)CH3 at 248 and 266 nm: pressure and temperature dependent overall quantum yields |
|
| H. Somnitz, T. Ufer, R. Zellner | Phys. Chem. Chem. Phys., 11, 8522-8531, (2009) | Acetone photolysis at 248 nm revisited: pressure dependence of the CO and CO2 quantum yields |
|
| C3D6O; CD3C(O)CD3; acetone-d6; CAS-No.: 666-52-4 | |||
| H. Ito, Y. Nogata, S. Matsuzaki, A. Kuboyama | Bull. Chem. Soc. Japan, 42, 2453-2458, (1969) | Vacuum-ultraviolet Absorption Spectra of Aliphatic Ketones |
|
| P.J. Singh, A. Shastri, B.N. Raja Sekhar, R. D'Souza, B.N. Jagatap | J. Quant. Spectr. Rad. Transfer, 114, 20-28, (2012) | Effect of isotopicsubstitution in the electronicabsorptionspectrum of acetone: VUV photoabsorption studies of acetone-d6 |
|
| related data (quantum yield studies; photolysis studies, etc.) | |||
| I. Szilágyi, G. Kovács, M. Farkas, G. L. Zügner, A. Gola, S. Dóbé, A. Demeter | Reaction Kinetics and Catalysis Letters, 96 (2), 437-446, (2009) | Photochemical and photophysical study on the kinetics of the atmospheric photodissociation of acetone |
|
| C3H5OCl; CH3C(O)CH2Cl; chloroacetone; CAS-No.: 78-95-5 | |||
| J.B. Burkholder, M.K. Gilles, T. Gierczak, A.R. Ravishankara | Geophys. Res. Lett. Vol. 29, No. 17, 1822, (2002) | The atmospheric degradation of 1-bromopropane (CH3CH2CH2Br): The photochemistry of bromoacetone |
|
| C4H8O; CH3C(O)C2H5; 2-butanone; methyl ethyl ketone; butan-2-one; MEK; CAS-No.: 78-93-3; PubChem: CID 6569 | |||
| V. McMillan | Calvert and Pitts, Photochemistry, John Wiley & Sons, London, p. 377, (1966) | (298 K) |
|
| H. Ito, Y. Nogata, S. Matsuzaki, A. Kuboyama | Bull. Chem. Soc. Japan, 42, 2453-2458, (1969) | Vacuum-ultraviolet Absorption Spectra of Aliphatic Ketones |
|
| W. Schneider, G.K. Moortgat | priv. comm., (1988) | MPI Mainz, 1988 (294 K) |
|
| R.D. Martinez, A.A. Buitrago, N.W. Howell, C.H. Hearn, J.A. Joens | Atmos. Environ. 26A, 785-792, (1992) | The near UV absorption spectra of several aliphatic aldehydes and ketones |
|
| M. Yujing, A. Mellouki | J. Photochem. Photobiol. A: Chem., 134, 31-36, (2000) | The near-UV absorption cross sections for several ketones |
|
| J.M. Hollas | Basic Atomic and Molecular Spectroscopy, 11, 146-170, (2002) | Electronic spectroscopy |
|
| R. Nádasdi, G.L. Zügner, M. Farkas, S. Dóbé, S. Maeda, K. Morokuma | ChemPhysChem, 11 (18), 3883-3895, (2010) | Photochemistry of Methyl Ethyl Ketone: Quantum Yields and S1/S0-Diradical Mechanism of Photodissociation |
|
| J. Chen, D.S. Venables | Atmos. Meas. Tech., 4, 425-436, (2011) | A broadband optical cavity spectrometer for measuring weak near-ultraviolet absorption spectra of gases |
|
| J.F. Brewer, D.K. Papanastasiou, J.B. Burkholder, E.V. Fischer, Y. Ren, A. Mellouki, A.R. Ravishankara | J. Geophys. Res. D, Atmospheres, 124 (11), 5906-5918, (2019) | Atmospheric Photolysis of Methyl Ethyl, Diethyl, and Propyl Ethyl Ketones: Temperature Dependent UV Absorption Cross Sections |
|
| 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 |
|
| related data (quantum yield studies; photolysis studies, etc.) | |||
| P. Ausloos, E.W.R. Steacie | Can. J. Chem., 33, 1062-1068, (1955) | The photolysis of methyl ethyl ketone |
|
| M.T.B. Romero, M.A. Blitz, D.E. Heard, M.J. Pilling, B. Price, P.W. Seakins, L. Wang | Faraday Discuss., 130, 73 - 88, (2005) | Photolysis of methylethyl, diethyl and methylvinyl ketones and their role in the atmospheric HOx budget |
|
| B. Rajakumar, T. Gierczak, J. Flad, A.R. Ravishankara, J.B. Burkholder | J. Photochem. Photobiol. A: Chem., 199, 336-344, (2008) | The CH3CO quantum yield in the 248 nm photolysis of acetone, methyl ethyl ketone, and biacetyl |
|
| C4H8O2; 3-hydroxy 2-butanone; acetoin; CAS-No.: 513-86-0 | |||
| L. Messaadia, G. El Dib, A. Ferhati, E. Roth, A. Chakir | Chem. Phys. Lett., 529, 16-22, (2012) | Gas phase UV absorption cross-sections for a series of hydroxycarbonyls |
|
| C4H8O2; 4-hydroxy-2-butanone; 4-hydroxybutan-2-one; CAS-No.: 590-90-9; PubChem: CID 111509 | |||
| L. Messaadia, G. El Dib, A. Ferhati, E. Roth, A. Chakir | Chem. Phys. Lett., 529, 16-22, (2012) | Gas phase UV absorption cross-sections for a series of hydroxycarbonyls |
|
| 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; 4-hydroxybutanal; 4-hydroxybutyraldehyde; CAS-No.: 25714-71-0; PubChem: CID 93093 | |||
| 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 |
|
| C5H10O2; 3-hydroxy-3-methyl-2-butanone; methylacetoin; CAS-No.: 115-22-0 | |||
| L. Messaadia, G. El Dib, A. Ferhati, E. Roth, A. Chakir | Chem. Phys. Lett., 529, 16-22, (2012) | Gas phase UV absorption cross-sections for a series of hydroxycarbonyls |
|
| C5H10O; n-C3H7COCH3; 2-pentanone; methyl n-propyl ketone; pentan-2-one; CAS-No.: 107-87-9; PubChem: 7895 | |||
| H. Ito, Y. Nogata, S. Matsuzaki, A. Kuboyama | Bull. Chem. Soc. Japan, 42, 2453-2458, (1969) | Vacuum-ultraviolet Absorption Spectra of Aliphatic Ketones |
|
| R.D. Martinez, A.A. Buitrago, N.W. Howell, C.H. Hearn, J.A. Joens | Atmos. Env. A, 26 (5), 785-792, (1992) | The near U.V. absorption spectra of several aliphatic aldehydes and ketones at 300 K |
|
| J. Chen, D.S. Venables | Atmos. Meas. Tech., 4, 425-436, (2011) | A broadband optical cavity spectrometer for measuring weak near-ultraviolet absorption spectra of gases |
|
| C5H10O; C2H5COC2H5; 3-pentanone; pentan-3-one; diethyl ketone; CAS-No.: 96-22-0; PubChem: CID 7288 | |||
| H. Ito, Y. Nogata, S. Matsuzaki, A. Kuboyama | Bull. Chem. Soc. Japan, 42, 2453-2458, (1969) | Vacuum-ultraviolet Absorption Spectra of Aliphatic Ketones |
|
| A.A. Scala | J. Phys. Chem., 74 (13), 2639-2645, (1970) | The photolysis and radiolysis of 3-methyl-2-butanone |
|
| J.D. Koch, R.K. Hanson | Applied Physics B: Lasers and Optics, 76, 319-324, (2003) | Temperature and excitation wavelength dependencies of 3-pentanone absorption and fluorescence for PLIF applications |
|
| J.D. Koch, J. Gronki, R.K. Hanson | Journal of Quantitative Spectroscopy & Radiative Transfer, 109, 2037–2044, (2008) | Measurements of near-UV absorption spectra of acetone and 3-pentanone at high temperatures |
|
| J.F. Brewer, D.K. Papanastasiou, J.B. Burkholder, E.V. Fischer, Y. Ren, A. Mellouki, A.R. Ravishankara | J. Geophys. Res. D, Atmospheres, 124 (11), 5906-5918, (2019) | Atmospheric Photolysis of Methyl Ethyl, Diethyl, and Propyl Ethyl Ketones: Temperature Dependent UV Absorption Cross Sections |
|
| 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 |
|
| related data (quantum yield studies; photolysis studies, etc.) | |||
| M.T.B. Romero, M.A. Blitz, D.E. Heard, M.J. Pilling, B. Price, P.W. Seakins, L. Wang | Faraday Discuss., 130, 73 - 88, (2005) | Photolysis of methylethyl, diethyl and methylvinyl ketones and their role in the atmospheric HOx budget |
|
| C5H10O; methyl isopropyl ketone; 3-methyl-2-butanone; 3-methylbutan-2-one; isopropyl methyl ketone; MIPK; CAS-No.: 563-80-4; PubChem: 11251 | |||
| H. Ito, Y. Nogata, S. Matsuzaki, A. Kuboyama | Bull. Chem. Soc. Japan, 42, 2453-2458, (1969) | Vacuum-ultraviolet Absorption Spectra of Aliphatic Ketones |
|
| A.A. Scala | J. Phys. Chem., 74 (13), 2639-2645, (1970) | The photolysis and radiolysis of 3-methyl-2-butanone |
|
| C6H12O; methyl n-butyl ketone; 2-hexanone; MBK; hexan-2-one; CAS-No.: 591-78-6; PubChem: 11583 | |||
| H. Ito, Y. Nogata, S. Matsuzaki, A. Kuboyama | Bull. Chem. Soc. Japan, 42, 2453-2458, (1969) | Vacuum-ultraviolet Absorption Spectra of Aliphatic Ketones |
|
| 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 |
|
| C5H8O2; CH3C(O)C(O)C2H5; 2,3-pentanedione; CAS-No.: 600-14-6 | |||
| A.W. Jackson, A.J. Yarwood | Can. J. Chem., 50 (9), 1331-1337, (1972) | Fluorescence and Phosphorescence of 2,3-Pentanedione |
|
| E. Szabó, M. Djehiche, M. Riva, C. Fittschen, P. Coddeville, D. Sarzynski, A. Tomas, S. Dóbé | J. Phys. Chem. A, 115 (33), 9160-9168, (2011) | Atmospheric Chemistry of 2,3-Pentanedione: Photolysis and Reactions with OH Radicals |
|
| L. Messaadia, G. El Dib, A. Ferhati, A. Chakir | Chem. Phys. Lett., 626, 73-79, (2015) | UV-visible spectra and gas-phase rate coefficients for the reaction of 2,3-pentanedione and 2,4-pentanedione with OH radicals |
|
| C7H14O; di-n-propyl ketone; 4-heptanone; heptan-4-one; CAS-No.: 123-19-3 | |||
| H. Ito, Y. Nogata, S. Matsuzaki, A. Kuboyama | Bull. Chem. Soc. Japan, 42, 2453-2458, (1969) | Vacuum-ultraviolet Absorption Spectra of Aliphatic Ketones |
|
| C7H14O; ((CH3)2CH)2C(O); 2,4-dimethyl-3-pentanone; diisopropyl ketone; CAS-No.: 565-80-0; PubChem: 11271 | |||
| H. Ito, Y. Nogata, S. Matsuzaki, A. Kuboyama | Bull. Chem. Soc. Japan, 42, 2453-2458, (1969) | Vacuum-ultraviolet Absorption Spectra of Aliphatic Ketones |
|
| M. Yujing, A. Mellouki | J. Photochem. Photobiol. A: Chem., 134, 31-36, (2000) | The near-UV absorption cross sections for several ketones |
|
| C7H14O; 2-heptanone; methyl n-amyl ketone; heptan-2-one; CAS-No.: 110-43-0; PubChem: 8051 | |||
| H. Ito, Y. Nogata, S. Matsuzaki, A. Kuboyama | Bull. Chem. Soc. Japan, 42, 2453-2458, (1969) | Vacuum-ultraviolet Absorption Spectra of Aliphatic Ketones |
|
| C6H12O; CH3C(O)CH2CH(CH3)2; 4-methyl-2-pentanone; hexone; methyl isobutyl ketone; 4-methylpentan-2-one; MIK; CAS-No.: 108-10-1 | |||
| S.F. Marsocci, S. MacKenzie | J. Am. Chem. Soc., 81 (17), 4513-4516, (1959) | The ultraviolet absorption spectra of certain aryl ketones, principally benzylacetones |
|
| H. Ito, Y. Nogata, S. Matsuzaki, A. Kuboyama | Bull. Chem. Soc. Japan, 42, 2453-2458, (1969) | Vacuum-ultraviolet Absorption Spectra of Aliphatic Ketones |
|
| M. Yujing, A. Mellouki | J. Photochem. Photobiol. A: Chem., 134, 31-36, (2000) | The near-UV absorption cross sections for several ketones |
|
| C6H12O; methyl s-butyl ketone; 3-methyl-2-pentanone; CAS-No.: 565-61-7; PubChem: 11262 | |||
| H. Ito, Y. Nogata, S. Matsuzaki, A. Kuboyama | Bull. Chem. Soc. Japan, 42, 2453-2458, (1969) | Vacuum-ultraviolet Absorption Spectra of Aliphatic Ketones |
|
| C6H12O; methyl tert-butyl ketone; 3,3-dimethylbutan-2-one; 3,3-dimethyl-2-butanone; pinacolone; CAS-No.: 75-97-8; PubChem: 6416 | |||
| H. Ito, Y. Nogata, S. Matsuzaki, A. Kuboyama | Bull. Chem. Soc. Japan, 42, 2453-2458, (1969) | Vacuum-ultraviolet Absorption Spectra of Aliphatic Ketones |
|
| C7H12O; CH3C(O)(CH)2CH(CH3)2; 5-methyl-2-hexanone; MIAK; CAS-No.: 110-12-3 | |||
| M. Yujing, A. Mellouki | J. Photochem. Photobiol. A: Chem., 134, 31-36, (2000) | The near-UV absorption cross sections for several ketones |
|
| C2H2O2; CHOCHO; glyoxal; CAS-No.: 107-22-2 | |||
| C.N. Plum, R. Atkinson, W.P.L. Carter, J.N. Pitts, Jr. | Environm. Sci. Technol., 17, 479-484, (1983) | OH Radical Rate Constants and Photolysis Rates of a-Dicarbonyls |
|
| M. Malik, J.A. Joens | Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy, 56, 2653-2658, (2000) | Temperature dependent near-UV molar absorptivities of glyoxal and gluteraldehyde in aqueous solution |
|
| J.J. Orlando, G.S. Tyndall | Int. J. Chem. Kinet., 33, 149-156, (2001) | The atmospheric chemistry of the HC(O)CO radical |
|
| A. Horowitz, R. Meller, G.K. Moortgat | J. Photochem. Photobiol. A: Chem., 146, 19-27, (2001) | The UV-VIS absorption cross sections of the alpha-dicarbonyl compounds: pyruvic acid, biacetyl and glyoxal |
|
| Y. Chen, L. Zhu | J. Phys. Chem. A, 107, 4643-4651, (2003) | Wavelength-dependent photolysis of glyoxal in the 290-420 nm region |
|
| R. Volkamer, P. Spietz, J. Burrows, U. Platt | J. Photochem. Photobiol. A: Chem., 172, 35-46, (2005) | High-resolution absorption cross-section of glyoxal in the UV–vis and IR spectral ranges |
|
| N.R. Goss, E.M. Waxman, S.C. Coburn, T.K. Koenig, R. Thalman, J. Dommen, J.W. Hannigan, G.S. Tyndall, R. Volkamar | J. Phys. Chem. A, 119 (19), 4651-4657, (2015) | Measurements of the Absorption Cross Section of 13CHO13CHO at Visible Wavelengths and Application to DOAS Retrievals |
|
| related data (quantum yield studies; photolysis studies, etc.) | |||
| G.W. Loge, C.S. Parmenter | J. Phys. Chem., 85 (12), 1653-1662, (1981) | Collision-free dissociation after excitation of single rotational levels in S1 glyoxal |
|
| L. Zhu, D. Kellis, C.-F. Ding | Chem. Phys. Lett., 257, 487-491, (1996) | Photolysis of glyoxal at 193, 248, 308, and 351 nm |
|
| J. Tadic, G.K. Moortgat, K. Wirtz | J. Photochem. Photobiol. A: Chemistry, 177, 116-124, (2006) | Photolysis of glyoxal in air |
|
| K.J. Feierabend, J.E. Flad, S.S. Brown, J.B. Burkholder | J. Phys. Chem. A, 113 (27), 7784-7794, (2009) | HCO Quantum Yields in the Photolysis of HC(O)C(O)H (Glyoxal) between 290 and 420 nm; supporting information available from ACS |
|
| R.J. Salter, M.A. Blitz, D.E. Heard, M.J. Pilling, P.W. Seakins | J. Phys. Chem. A, 113, 8278–8285, (2009) | New Chemical Source of the HCO Radical Following Photoexcitation of Glyoxal, (HCO)2 |
|
| C3H6O2; CH3C(O)CH2OH; acetol; hydroxyacetone; CAS-No.: 116-09-6 | |||
| R. Meller, J.N. Crowley | priv. comm., (1990) | MPI Mainz, (296 K) |
|
| J.J. Orlando, G.S. Tyndall, J.-M. Fracheboud, E.G. Estupiña, S. Haberkorn, A. Zimmer | Atmos. Env., 33, 1621-1629, (1999) | The rate and mechanism of the gas-phase oxidation of hydroxyacetone |
|
| N.I. Butkovskaya, N. Pouvesle, A. Kukui, Y. Mu, G. Le Bras | J. Phys. Chem. A, 110 (21), 6833-6843, (2006) | Mechanism of the OH-initiated oxidation of hydroxyacetone over the temperature range 236-298 K |
|
| L. Messaadia, G. El Dib, A. Ferhati, E. Roth, A. Chakir | Chem. Phys. Lett., 529, 16-22, (2012) | Gas phase UV absorption cross-sections for a series of hydroxycarbonyls |
|
| C4H6O; CH3COCHCH2; methyl vinyl ketone; MVK; 3-buten-2-one; butenone; CAS-No.: 78-94-4; PubChem: CID 6570 | |||
| W. Schneider, G.K. Moortgat | priv. comm., (1989) | UV spectrum of methyl vinyl ketone |
|
| A. Fahr, W. Braun, A.H. Laufer | J. Phys. Chem., 97, 1502-1506, (1993) | Photolysis of methyl vinyl ketone at 193.3 nm: quantum yield determination of methyl and vinyl radicals |
|
| T. Gierczak, J.B. Burkholder, R.K. Talukdar, A. Mellouki, S.B. Barone, A.R. Ravishankara | J. Photochem. Photobiol. A: Chem., 110, 1-10, (1997) | Atmospheric fate of methyl vinyl ketone and methacrolein |
|
| 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.M. Davis, A.L. Koritzke, M.G. Christianson, J.M. Turney, H.F. Schaefer III, L. Sheps, D.L. Osborn, C.A. Taatjes, B. Rotavera | Int. J. Chem. Kin., 53 (1), 127-145, (2021) | Isomer-Dependent Reaction Mechanisms of Cyclic Ether Intermediates: cis-2,3-dimethyloxirane and trans-2,3-dimethyloxirane |
|
| 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 |
|
| related data (quantum yield studies; photolysis studies, etc.) | |||
| M.T.B. Romero, M.A. Blitz, D.E. Heard, M.J. Pilling, B. Price, P.W. Seakins, L. Wang | Faraday Discuss., 130, 73 - 88, (2005) | Photolysis of methylethyl, diethyl and methylvinyl ketones and their role in the atmospheric HOx budget |
|
| M.E. Earle, R. Mills, J.M. Roscoe | J. Photochem. Photobiol. A: Chemistry, 206, 71-79, (2009) | The photolysis of methyl vinyl ketone at 308nm |
|
| C5H8O; ethyl vinyl ketone; 1-penten-3-one; CAS-No.: 1629-58-9 | |||
| 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 |
|
| C5H8O; cyclopentanone; adipic ketone; CAS-No.: 120-92-3; PubChem: CID 8452 | |||
| 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 |
|
| C4H4N2O; imidazole-2-carboxaldehyde; 2-formylimidazole; CAS-No.: 10111-08-7; PubChem: CID 24955 | |||
| T. Felber, T. Schaefer, H. Herrmann | J. Phys. Chem. A, 123, 8, 1505–1513, (2019) | OH-initiated oxidation of imidazoles in tropospheric aqueous-phase chemistry |
|
| C6H8O; cyclohexene-3-one; 2-cyclohexen-1-one; CAS-No.: 930-68-7; PubChem: CID 13594 | |||
| 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; cyclohexene-4-one; 3-cyclohexen-1-one; CAS-No.: 4096-34-8; PubChem: CID 77727 | |||
| 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; 2-methyl-2-cyclopenten-1-one; 2-methylcyclopent-2-enone; CAS-No.: 1120-73-6; PubChem: CID 14266 | |||
| 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 |
|
| C6H10O; cyclohexanone; cyclohexyl ketone; CAS-No.: 108-94-1; PubChem: CID 7967 | |||
| S.F. Marsocci, S. MacKenzie | J. Am. Chem. Soc., 81 (17), 4513-4516, (1959) | The ultraviolet absorption spectra of certain aryl ketones, principally benzylacetones |
|
| E. Iwasaki, Y. Matsumi, K. Takahashi, T.J. Wallington, M.D. Hurley, J.J. Orlando, E.W. Kaiser, J.G. Calvert | Int. J. Chem. Kin., 40, 223-229, (2008) | Atmospheric chemistry of cyclohexanone: UV spectrum and kinetics of reaction with chlorine atoms |
|
| 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 |
|
| C6H12O; 3-hexanone; propyl ethyl ketone; hexan-3-one; CAS-No.: 589-38-8; PubChem: 11509 | |||
| J.F. Brewer, D.K. Papanastasiou, J.B. Burkholder, E.V. Fischer, Y. Ren, A. Mellouki, A.R. Ravishankara | J. Geophys. Res. D, Atmospheres, 124 (11), 5906-5918, (2019) | Atmospheric Photolysis of Methyl Ethyl, Diethyl, and Propyl Ethyl Ketones: Temperature Dependent UV Absorption Cross Sections |
|
| C6H12O; 2-methyl-3-pentanone; ethyl isopropyl ketone; CAS-No.: 565-69-5; PubChem: 11265 | |||
| Y. Ren, F. Bernard, V. Daele, A. Mellouki | Env. Sci. Tech., 53 (15), 8862-8871, (2019) | Atmospheric Fate and Impact of Perfluorinated Butanone and Pentanone |
|
| C8H8O; phenylacetaldehyde; phenylethanal; CAS-No.: 122-78-1; PubChem: 998 | |||
| W.D. Kumler, L.A. Strait, E.L. Alpen | J. Am. Chem. Soc., 72 (4), 1463-1466, (1950) | The ultraviolet absorption spectra of alpha-phenylcarbonyl compounds |
|
| C9H8O; trans-cinnamaldehyde; cinnamic aldehyde; trans-3-phenyl-2-propenal; CAS-No.: 104-55-2; CAS-No.: 14371-10-9; PubChem: CID 637511 | |||
| G. Adembri, P. Sarti-Fantoni, E. Belgodere | Tetrahedron, 22 (9), 3149-3156, (1966) | Ultraviolet spectra of hydrazones - I |
|
| 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 |
|
| C9H10O; beta-phenylpropionaldehyde; 3-phenylpropionaldehyd; CAS-No.: 104-53-0 | |||
| W.D. Kumler, L.A. Strait, E.L. Alpen | J. Am. Chem. Soc., 72 (4), 1463-1466, (1950) | The ultraviolet absorption spectra of alpha-phenylcarbonyl compounds |
|
| C10H10O; benzalacetone; methyl styryl ketone; CAS-No.: 122-57-6; PubChem: 637759 | |||
| N.H. Cromwell, W.R. Watson | J. Org. Chem., 14 (3), 411-420, (1949) | Ultraviolet absorption spectra of some amino-substituted unsaturated ketones |
|
| C10H12O; benzylacetone; 4-phenyl-2-butanone; CAS-No.: 2550-26-7; PubChem: 17355 | |||
| S.F. Marsocci, S. MacKenzie | J. Am. Chem. Soc., 81 (17), 4513-4516, (1959) | The ultraviolet absorption spectra of certain aryl ketones, principally benzylacetones |
|
| C10H12O; gamma-phenylbutyraldehyde; 4-phenylbutanal; 4-phenylbutyraldehyde; CAS-No.: 18328-11-5; PubChem: 29030 | |||
| W.D. Kumler, L.A. Strait, E.L. Alpen | J. Am. Chem. Soc., 72 (4), 1463-1466, (1950) | The ultraviolet absorption spectra of alpha-phenylcarbonyl compounds |
|
| C10H14O; myrtenal; (1R)-(-)-myrtenal; 6,6-dimethylbicyclo[3.1.1]hept-2-en-2-carboxaldehyde; CAS-No.: 564-94-3; PubChem: CID 61130 | |||
| M. Fakih, E. Roth, S. Gatard, R. Plantier-Royon, A. Chakir | Chem. Phys. Lett., 803, 139832, (2022) | Gas-phase UV absorption spectra of a series of of terpenic oxygenated VOC: Nopinone, Myrtenal, Ketolimonene, Limononaldehyde and Caronaldehyde |
|
| C10H16O; camphor; 1,7,7-trimethylbicyclo[2.2.1]heptan-2-one; 2-bornanone; CAS-No.: 76-22-2; PubChem: 2537 | |||
| S.F. Marsocci, S. MacKenzie | J. Am. Chem. Soc., 81 (17), 4513-4516, (1959) | The ultraviolet absorption spectra of certain aryl ketones, principally benzylacetones |
|
| C10H16O; fenchone; 1,3,3-trimethylbicyclo[2.2.1]heptan-2-one; CAS-No.: 1195-79-5; PubChem: PubChem: CID 14525 | |||
| D.P. Singh, N. De Oliveira, G.A. Garcia, A. Vredenborg, I. Powis | Chem. Phys. Chem., 21 (21) 2468-2483, (2020) | An Experimental and Theoretical Investigation of the 3sp(d) Rydberg States of Fenchone by Polarized Laser Resonance-Enhanced-MultiphotonIonization and Fourier Transform VUV Absorption Spectroscopy |
|
| C3H4O2; glycidaldehyde; CAS-No.: 765-34-4 | |||
| S. Ma, I. Barnes, K.H. Becker | Env. Sci. Tech., 32, 3515-3521, (1998) | Atmospheric Degradation of Glycidaldehyde: Photolysis and Reaction with OH Radicals |
|
| C3H4O2; malondialdehyde; malonaldehyde; propanedial; CAS-No.: 542-78-9; PubChem: CID 10964 | |||
| T.-W. Kwon, J. van der Veen | J. Agric. Food Chem., 16 (4), 639-642, (1968) | Ultraviolet and infrared absorption spectra of malonaldehyde in organic solvents |
|
| C3H6O3; glyceraldehyde; (R)-2,3-dihydroxypropanal; CAS-No.: 453-17-8; PubChem: CID 79014 | |||
| S.A. Epstein, E. Tapavicza, F. Furche, S.A. Nizkorodov | Atmos. Chem. Phys., 13, 9461-9477, (2013) | Direct photolysis of carbonyl compounds dissolved in cloud andfog droplets |
|
| C3H6O3; dihydroxyacetone; glycerone; DHA; CAS-No.: 96-26-4; PubChem: CID 670 | |||
| S.A. Epstein, E. Tapavicza, F. Furche, S.A. Nizkorodov | Atmos. Chem. Phys., 13, 9461-9477, (2013) | Direct photolysis of carbonyl compounds dissolved in cloud andfog droplets |
|
| C4H4O2; butenedial; malealdehyde; 2-butenedial; CAS-No.: 2363-83-9 | |||
| D.L. Hufford, D.S. Tarbell, T.R. Koszalka | J. Am. Chem. Soc., 74 (12), 3014-3018, (1952) | Maleic and Fumaric Dialdehydes, Delta4-Tetrahydrophthalaldehyde and Related Compounds |
|
| Y. Tang, L. Zhu | Chem. Phys. Lett., 409 (4-6), 151-156, (2005) | Photolysis of butenedial at 193, 248, 280, 308, 351, 400, and 450 nm |
|
| M. Ammann, R.A. Cox, J.N. Crowley, H. Herrmann, E. Jenkin, V.F. McNeill, A. Mellouki, J. Troe, T.J. Wallington | IUPAC, data sheet P26, (2012) | Task Group on Atmospheric Chemical Kinetic Data Evaluation – Evaluated Kinetic Data |
|
| C4H6O; 3-butenal; but-3-enal; CAS-No.: 7319-38-2; PubChem: CID 123248 | |||
| 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 |
|
| C4H6O; cyclobutanone; CAS-No.: 1191-95-3; PubChem: CID 14496 | |||
| A. Udvarhazi, M.A. El-Sayed | J. Chem. Phys., 42 (9), 3335-3336, (1965) | Vacuum-ultraviolet spectra of cyclic ketones |
|
| D.C. Moule | Can. J. Physics, 47 (11), 1235-1236, (1969) | The 3300 A band system of cyclobutanone |
|
| C4H6O2; biacetyl; butanedione; butane-2,3-dione; diacetyl; CAS-No.: 431-03-8; PubChem: CID 650 | |||
| V.R. Ells | J. Am. Chem. Soc., 60 (8), 1864-1866, (1938) | The absorption spectrum of biacetyl between 1500 and 2000 A |
|
| L.S. Forster | J. Am. Chem. Soc., 77 (6), 1417-1421, (1955) | The effect of solvent on the visible absorption spectrum of biacetyl |
|
| 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.C. Doner, M.M. Davis, A.L. Koritzke, M.G. Christianson, J.M. Turney, H.F. Schaefer III, L. Sheps, D.L. Osborn, C.A. Taatjes, B. Rotavera | Int. J. Chem. Kin., 53 (1), 127-145, (2021) | Isomer-Dependent Reaction Mechanisms of Cyclic Ether Intermediates: cis-2,3-dimethyloxirane and trans-2,3-dimethyloxirane |
|
| 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 |
|
| related data (quantum yield studies; photolysis studies, etc.) | |||
| W.E. Bell, F.E. Blacet | J. Am. Chem. Soc., 76, 5332-5337, (1954) | The Photolysis of Biacetyl |
|
| B. Rajakumar, T. Gierczak, J. Flad, A.R. Ravishankara, J.B. Burkholder | J. Photochem. Photobiol. A: Chem., 199, 336-344, (2008) | The CH3CO quantum yield in the 248 nm photolysis of acetone, methyl ethyl ketone, and biacetyl |
|
| C4H6O2; 2-oxobutanal; ethylglyoxal; CAS-No.: 4417-81-6; PubChem: CID 145744 | |||
| 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; methoxyacetone; methoxy-2-propanone; CAS-No.: 5878-19-3; PubChem: 22172 | |||
| S.F. Marsocci, S. MacKenzie | J. Am. Chem. Soc., 81 (17), 4513-4516, (1959) | The ultraviolet absorption spectra of certain aryl ketones, principally benzylacetones |
|
| related data (quantum yield studies; photolysis studies, etc.) | |||
| R. Srinivasan | J. Am. Chem. Soc., 84, 13, 2475–2478, (1962) | Photochemistry of Methoxyacetone |
|
| C5H6O; 2-cyclopenten-1-one; 2-cyclopentenone; CAS-No.: 930-30-3; PubChem: CID 13588 | |||
| 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 |
|
| C5H6O; 3-cyclopenten-1-one; 3-cyclopentenone; CAS-No.: 14320-37-7; PubChem: CID 84351 | |||
| 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 |
|
| C5H6O2; 4-oxo-2-pentenal; CAS-No.: 5729-47-5 | |||
| B. Xiang, L. Zhu, Y. Tang | J. Phys. Chem. A, 111 (37), 9025-9033, (2007) | Photolysis of 4-Oxo-2-pentenal in the 190-460 nm Region |
|
| C5H6O2; 2,3-epoxycyclopentan-1-one; 2,3-epoxycyclopentanone; CAS-No.: 6705-52-8 | |||
| 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 |
|
| C5H6O2; 3,4-epoxycyclopentanone; 6-oxabicyclo[3.1.0]hexan-3-one; CAS-No.: 74017-10-0; PubChem: CID 535532 | |||
| 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 |
|
| C5H8O2; acetylacetone; 2,4-pentanedione; pentan-2,4-dion; CAS-No.: 123-54-6; PubChem: 31261 | |||
| R.S. Rasmussen, D.D. Tunnicliff, R.R. Brattain | J. Am. Chem. Soc., 71 (3), 1068-1072, (1949) | Infrared and Ultraviolet Spectroscopic Studies on Ketones |
|
| H. Nakanishi, H. Morita, S. Nagakura | Bull. Chem. Soc. Japan, 51 (6), 1723-1729, (1978) | Charge-Transfer Character in the Intramolecular Hydrogen Bond: Vacuum Ultraviolet Spectra of Acetylacetone and Its Fluoro Derivatives |
|
| C. Bernasconi, A. Kanavarioti | J. Am. Chem. Soc., 108, 24, 7744–7751, (1986) | Nucleophilic additions to olefins. 19. Abnormally high intrinsic barrier in the reaction of piperidine and morpholine with benzylideneacetylacetone |
|
| L. Messaadia, G. El Dib, A. Ferhati, A. Chakir | Chem. Phys. Lett., 626, 73-79, (2015) | UV-visible spectra and gas-phase rate coefficients for the reaction of 2,3-pentanedione and 2,4-pentanedione with OH radicals |
|
| C5H8O2; glutaraldehyde; pentanedial; CAS-No.: 111-30-8; PubChem: CID 3485 | |||
| 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 |
|
| C6H12O2; 4-hydroxy-4-methyl-2-pentanone; diacetone alcohol; DAA; CAS-No.: 123-42-2; PubChem: CID 31256 | |||
| L. Aslan, H. Laversin, P. Coddeville, C. Fittschen, E. Roth, A. Tomas, A. Chakir | Atmos. Env., 150, 256-263, (2017) | Kinetics of the photolysis and OH reaction of 4-hydroxy-4-methyl-2-pentanone: Atmospheric implications |
|
| C6H12O2; 4-hydroxy-3-hexanone; propioin; 4-hydroxyhexan-3-one; CAS-No.: 4984-85-4; PubChem: CID 95609 | |||
| L. Aslan, H. Laversin, E. Roth, P. Coddeville, C. Fittschen, A. Chakir, A. Tomas | Chem. Phys. Lett., 688, 43-46, (2017) | Gas-phase UV absorption cross-sections and photolysis kinetics of 4-hydroxy-3-hexanone: Atmospheric implications |
|
| C6H12O3; 2-Hexanone,5-hydroperoxy; CAS-No.: 245094-61-5 | |||
| F. Jorand, L. Kerhoas, A. Heiss, J. Einhorn, K. Sahetchian | J. Photochem. Photobiol. A: Chem., 134, 119-125, (2000) | Determination of the ultraviolet absorption cross section of hexyl-ketohydroperoxides in solution in acetonitrile |
|
| C6H12O3; 2-hexanone-4-hydroperoxide/3-hexanone-5-hydroperoxide mixture; CAS-No.: 287473-93-2 | |||
| F. Jorand, L. Kerhoas, A. Heiss, J. Einhorn, K. Sahetchian | J. Photochem. Photobiol. A: Chem., 134, 119-125, (2000) | Determination of the ultraviolet absorption cross section of hexyl-ketohydroperoxides in solution in acetonitrile |
|
| C2H2O; CH2CO; ketene; ethenone; CAS-No.: 463-51-4; PubChem: CID 10038 | |||
| W.C. Price, J.P. Teegan, A.D. Walsh | J. Chem. Soc., 920, (1951) | The absorption spectrum of keten in the far ultra-violet |
|
| R.N. Dixon, G.H. Kirby | Trans. Faraday Soc., 62, 1406-1410, (1966) | Absorption spectrum of ketene in the visible and near ultra-violet |
|
| A.H. Laufer, R.A. Keller | J. Am. Chem. Soc., 93, 61-63, (1971) | Lowest excited states of ketene |
|
| 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, etc.) | |||
| W.G. Paterson, H. Gesser | Can. J. Chem., 35, 1137-1138, (1957) | The photolysis of ketene at low temperatures |
|
| C5H4O2; 2-furanaldehyde; furfural; CAS-No.: 98-01-1; PubChem: CID 7362 | |||
| M.L. Wolfrom, R.D. Schuetz, L.F. Cavalieri | J. Am. Chem. Soc., 71, 10, 3518–3523, (1949) | Chemical Interactions of Amino Compounds and Sugars. IV. Significance of Furan Derivatives in Color Formation |
|
| T. Psarras, J.W. Tefteller, H.K. Zimmerman | Recueil des Travaux Chimiques des Pays-Bas, 80 (2), 232-236, (1961) | Ultraviolet absorption spectra of 1-furfural and of 5-hydroxymethyl-furfural in aqueous buffers |
|
| 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) |
|
| I. Colmenar, S. Gonzales, E. Jimenez, P. Martin, S. Salgado, B. Cabanas, J. Albaladejo | Atmos. Env., 103, 1-6, (2015) | UV absorption cross sections between 290 and 380 nm of a series of furanaldehydes: Estimation of their photolysis lifetimes |
|
| F. Ferreira da Silva, E. Lange, P. Limão-Vieira, N.C. Jones, S.V. Hoffmann, M.-J. Hubin-Franskin, J. Delwiche, M. J. Brunger, R.F.C. Neves, M.C.A. Lopes, E.M. de Oliveira, R.F. da Costa, M.T. do N. Varella, M.H.F. Bettega, F. Blanco, G. García, M.A.P. Lima, D.B. Jones | J. Chem. Phys., 143, 144308, (2015) | Electronic Excitation of Furfural as probed by High-Resolution Vacuum Ultraviolet Spectroscopy, Electron Energy Loss Spectroscopy and ab initio Calculations |
|
| C5H4O2; 3-furanaldehyde; 3-furaldehyde; CAS-No.: 498-60-2; PubChem: CID 10351 | |||
| I. Colmenar, S. Gonzales, E. Jimenez, P. Martin, S. Salgado, B. Cabanas, J. Albaladejo | Atmos. Env., 103, 1-6, (2015) | UV absorption cross sections between 290 and 380 nm of a series of furanaldehydes: Estimation of their photolysis lifetimes |
|
| C6H6O2; 5-methyl-2-furanaldehyde; 5-methyl-2-furaldehyde; CAS-No.: 620-02-0; PubChem: CID 12097 | |||
| I. Colmenar, S. Gonzales, E. Jimenez, P. Martin, S. Salgado, B. Cabanas, J. Albaladejo | Atmos. Env., 103, 1-6, (2015) | UV absorption cross sections between 290 and 380 nm of a series of furanaldehydes: Estimation of their photolysis lifetimes |
|
| C7H6O2; 4-hydroxybenzaldehyde; p-hydroxybenzaldehyde; CAS-No.: 123-08-0; PubChem: CID 126 | |||
| J.C. Dearden , W.F. Forbes | Can. J. Chem., 37(8), 1294-1304, (1959) | Light absorption studies: Part XIV. The ultraviolet absorption spectra of phenols |
|
| C7H6O2; 3-hydroxybenzaldehyde; m-hydroxybenzaldehyde; CAS-No.: 100-83-4; PubChem: CID 101 | |||
| J.C. Dearden, W.F. Forbes | Can. J. Chem., 37(8), 1294-1304, (1959) | Light absorption studies: Part XIV. The ultraviolet absorption spectra of phenols |
|
| C7H6O2; 2-hydroxybenzaldehyde; o-hydroxybenzaldehyde; salicylaldehyde; CAS-No.: 90-02-8; PubChem: CID 6998 | |||
| J.C. Dearden, W.F. Forbes | Can. J. Chem., 37(8), 1294-1304, (1959) | Light absorption studies: Part XIV. The ultraviolet absorption spectra of phenols |
|
| C8H16O4; metaldehyde; metacetaldehyde; CAS-No.: 108-62-3; PubChem: CID 61021 | |||
| M. Spangenberg, J.I. Bryant, S.J. Gibson, P.J. Mousley, Y. Ramachers, G.R. Bell | Scientific Reports, 11, 3682, (2022) | Ultraviolet absorption of contaminants in water |
|
| C9H6O2; coumarin; 2H-chromen-2-one; CAS-No.: 91-64-5; PubChem: 323; for additional coumarin compounds see dyes or substance-list | |||
| R.H. Goodwin, B.M. Pollock | Archives of Biochem. and Biophys., 49 (1), 1-6, (1954) | Ultraviolet absorption spectra of coumarin derivatives |
|
| R.H. Abu-Eittah, Bahgat Ali H. El-Tawil | Can. J. Chem., 63(6): 1173-1179, (1985) | The electronic absorption spectra of some coumarins. A molecular orbital treatment |
|
| C9H6O3; umbelliferone; 7-hydroxychromen-2-one; 7-hydroxycoumarin; CAS-No.: 93-35-6; PubChem: 5281426; for additional coumarin compounds see dyes or substance-list | |||
| R.H. Abu-Eittah, Bahgat Ali H. El-Tawil | Can. J. Chem., 63(6): 1173-1179, (1985) | The electronic absorption spectra of some coumarins. A molecular orbital treatment |
|
| C9H6O4; esculetin; aesculetin; 6,7-dihydroxy-2-chromenone; 6,7-dihydroxycoumarin; CAS-No.: 305-01-1; PubChem: 5281416; for additional coumarin compounds see dyes or substance-list | |||
| R.H. Abu-Eittah, Bahgat Ali H. El-Tawil | Can. J. Chem., 63(6): 1173-1179, (1985) | The electronic absorption spectra of some coumarins. A molecular orbital treatment |
|
| C10H8O4; scopoletin; 7-hydroxy-6-methoxychromen-2-one; CAS-No.: 92-61-5; PubChem: 5280460 | |||
| R.H. Abu-Eittah, Bahgat Ali H. El-Tawil | Can. J. Chem., 63(6): 1173-1179, (1985) | The electronic absorption spectra of some coumarins. A molecular orbital treatment |
|
| C7H8O2; 2-furylacetone; furfuryl methyl ketone; CAS-No.: 6975-60-6; PubChem: 228583 | |||
| S.F. Marsocci, S. MacKenzie | J. Am. Chem. Soc., 81 (17), 4513-4516, (1959) | The ultraviolet absorption spectra of certain aryl ketones, principally benzylacetones |
|
| C8H10O2; furfuryl acetone; 4-(2-furyl)butan-2-one; CAS-No.: 699-17-2; PubChem: 12780 | |||
| S.F. Marsocci, S. MacKenzie | J. Am. Chem. Soc., 81 (17), 4513-4516, (1959) | The ultraviolet absorption spectra of certain aryl ketones, principally benzylacetones |
|
| C10H16O2; pinonaldehyde; CAS-No.: 2704-78-1 | |||
| M. Hallquist, I. Wängberg, E. Ljungström | Env. Sci. Tech., 31 (11), 3166-3172, (1997) | Atmospheric Fate of Carbonyl Oxidation Products Originating from alpha-Pinene and DELTA3-Carene: Determination of Rate of Reaction with OH and NO3 Radicals, UV Absorption Cross Sections, and Vapor Pressures |
|
| C10H16O2; caronaldehyde; 2-[2,2-dimethyl-3-(2-oxopropyl)cyclopropyl]acetaldehyde; CAS-No.: 26946-56-5; PubChem: CID 10888310 | |||
| M. Hallquist, I. Wängberg, E. Ljungström | Environ. Sci. Technol., 31 (11), 3166-3172, (1997) | Atmospheric Fate of Carbonyl Oxidation Products Originating from alpha-Pinene and DELTA3-Carene: Determination of Rate of Reaction with OH and NO3 Radicals, UV Absorption Cross Sections, and Vapor Pressures |
|
| M. Fakih, E. Roth, S. Gatard, R. Plantier-Royon, A. Chakir | Chem. Phys. Lett., 803, 139832, (2022) | Gas-phase UV absorption spectra of a series of of terpenic oxygenated VOC: Nopinone, Myrtenal, Ketolimonene, Limononaldehyde and Caronaldehyde |
|
| C10H16O2; limononaldehyde; 6-oxo-3-prop-1-en-2-ylheptanal; CAS-No.: 7086-79-5; PubChem: CID | |||
| M. Fakih, E. Roth, S. Gatard, R. Plantier-Royon, A. Chakir | Chem. Phys. Lett., 803, 139832, (2022) | Gas-phase UV absorption spectra of a series of of terpenic oxygenated VOC: Nopinone, Myrtenal, Ketolimonene, Limononaldehyde and Caronaldehyde |
|
| C3H4O; cyclopropanone; CAS-No.: 5009-27-8; PubChem: 138404 | |||
| T.F. Thomas, H.J. Rodriguez | J. Am. Chem. Soc., 93 (22), 5918-5920, (1971) | Photochemistry of Cyclopropanone |
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| C6H12O; 2-methoxy-3-pentanone; CAS-No.: 17042-18-1 | |||
| L.P.Y. Lee, B. McAneney, J.E. Guillet | Can. J. Chem., 49, 1310-1314, (1971) | Photolysis of 4-Methyl 3-Hexanone and 2-Methoxy 3-Pentanone in Hydrocarbon Solution |
|
| C7H14O; 4-methyl-3-hexanone; 3-hexanone, 4-methyl-; CAS-No.: 17042-16-9; PubChem: CID 86501 | |||
| L.P.Y. Lee, B. McAneney, J.E. Guillet | Can. J. Chem., 49, 1310-1314, (1971) | Photolysis of 4-Methyl 3-Hexanone and 2-Methoxy 3-Pentanone in Hydrocarbon Solution |
|
| C9H14O; isophorone; 3,5,5-trimethyl-2-cyclohexene-1-one, CAS-No.: 78-59-1; PubChem: 6544 | |||
| R.S. Rasmussen, D.D. Tunnicliff, R.R. Brattain | J. Am. Chem. Soc., 71 (3), 1068-1072, (1949) | Infrared and Ultraviolet Spectroscopic Studies on Ketones |
|
| C9H14O; ketolimonene; 4-acetyl-1-methylcyclohexene; CAS-No.: 6090-09-1; PubChem: CID 93019 | |||
| M. Fakih, E. Roth, S. Gatard, R. Plantier-Royon, A. Chakir | Chem. Phys. Lett., 803, 139832, (2022) | Gas-phase UV absorption spectra of a series of of terpenic oxygenated VOC: Nopinone, Myrtenal, Ketolimonene, Limononaldehyde and Caronaldehyde |
|
| C9H14O; nopinone; 6,6-dimethylbicyclo[3.1.1] heptan-2-one; CAS-No.: 38651-65-9; PubChem: CID | |||
| M. Fakih, E. Roth, S. Gatard, R. Plantier-Royon, A. Chakir | Chem. Phys. Lett., 803, 139832, (2022) | Gas-phase UV absorption spectra of a series of of terpenic oxygenated VOC: Nopinone, Myrtenal, Ketolimonene, Limononaldehyde and Caronaldehyde |
|
| C9H18O6; triacetone triperoxide; TATP; acetonperoxid; peroxyacetone; CAS-No.: 17088-37-8; PubChem: CID 4380970 | |||
| J.K. Cooper, C.D. Grant, J.Z. Zhang | J. Phys. Chem. A, 117 (29), 6043-6051, (2013) | Experimental and TD-DFT Study of Optical Absorption of Six Explosive Molecules: RDX, HMX, PETN, TNT, TATP, and HMTD |
|
| C12H10O; diphenyl ether; diphenyl oxide; phenoxybenzene; CAS-No.: 101-84-8; PubChem: CID 7583 | |||
| W.W. Robertson, A.J. Seriff, F.A. Matsen | J. Am. Chem. Soc., 72, 4, 1539-1543, (1950) | The effect of o-deuteration and o-substitution on the ultraviolet absorption spectrum of phenol |
|
| C15H10O; 9-anthraldehyde; 9-anthracenecarbaldehyde; CAS-No.: 642-31-9; PubChem: 69504 | |||
| R.N. Jones | Chem. Rev., 41 (2), 353-371, (1947) | The ultraviolet absorption spectra of anthracene derivatives |
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| C15H10O; 9-formylphenanthrene; 9-phenanthraldehyde; 9-phenanthrenaldehyde; CAS-No.: 4707-71-5 | |||
| S. Akiyama, M. Nakagawa, K. Nishimoto | Bull. Chem. Soc. Japan, 44 (4), 1054-1062, (1971) | Electronic spectra of phenanthrene derivatives. Effect of substitution |
|
| C15H10O; 3-formylphenanthrene; 3-phenanthraldehyde; 3-phenanthrenaldehyde; CAS-No.: | |||
| S. Akiyama, M. Nakagawa, K. Nishimoto | Bull. Chem. Soc. Japan, 44 (4), 1054-1062, (1971) | Electronic spectra of phenanthrene derivatives. Effect of substitution |
|
| C15H10O; 2-formylphenanthrene; 2-phenanthraldehyde; 2-phenanthrenaldehyde; CAS-No.: | |||
| S. Akiyama, M. Nakagawa, K. Nishimoto | Bull. Chem. Soc. Japan, 44 (4), 1054-1062, (1971) | Electronic spectra of phenanthrene derivatives. Effect of substitution |
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