2-Butanone, 3-chloro-3-methyl-
- Formula: C5H9ClO
- Molecular weight: 120.577
- IUPAC Standard InChI: InChI=1S/C5H9ClO/c1-4(7)5(2,3)6/h1-3H3
- IUPAC Standard InChIKey: FTJRNNIDCLELRD-UHFFFAOYSA-N
- CAS Registry Number: 5950-19-6
- Chemical structure:
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Gas phase ion energetics data
Go To: Top, Gas Chromatography, References, Notes
Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.
Data compiled by: Sharon G. Lias, John E. Bartmess, Joel F. Liebman, John L. Holmes, Rhoda D. Levin, and W. Gary Mallard
Ionization energy determinations
| IE (eV) | Method | Reference |
|---|---|---|
| 9.7 | EI | Dommrose and Grutzmacher, 1987 |
Gas Chromatography
Go To: Top, Gas phase ion energetics data, References, Notes
Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.
Data compiled by: NIST Mass Spectrometry Data Center, William E. Wallace, director
Normal alkane RI, non-polar column, temperature ramp
| Column type | Active phase | I | Reference | Comment |
|---|---|---|---|---|
| Capillary | OV-101 | 763. | Zenkevich, 2005 | 25. m/0.20 mm/0.10 μm, N2/He, 6. K/min; Tstart: 50. C; Tend: 250. C |
References
Go To: Top, Gas phase ion energetics data, Gas Chromatography, Notes
Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.
Dommrose and Grutzmacher, 1987
Dommrose, A.; Grutzmacher, H.,
Destablized carbenium ions: A-acetyl-a,a-dimethylmethyl cations,
Int. J. Mass Spectrom. Ion Processes, 1987, 76, 95. [all data]
Zenkevich, 2005
Zenkevich, I.G.,
Experimentally measured retention indices., 2005. [all data]
Notes
Go To: Top, Gas phase ion energetics data, Gas Chromatography, References
- Data from NIST Standard Reference Database 69: NIST Chemistry WebBook
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