3-Hexen-2-one
- Formula: C6H10O
- Molecular weight: 98.1430
- IUPAC Standard InChI: InChI=1S/C6H10O/c1-3-4-5-6(2)7/h4-5H,3H2,1-2H3
- IUPAC Standard InChIKey: LPCWMYHBLXLJJQ-UHFFFAOYSA-N
- CAS Registry Number: 763-93-9
- Chemical structure:
This structure is also available as a 2d Mol file - Stereoisomers:
- Other names: 1-Butenyl methyl ketone; Methyl 1-butenyl ketone; Hex-3-en-2-one
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Normal alkane RI, non-polar column, temperature ramp
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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
| Column type | Capillary | Capillary |
|---|---|---|
| Active phase | HP-5 MS | DB-1 |
| Column length (m) | 25. | |
| Carrier gas | Helium | |
| Substrate | ||
| Column diameter (mm) | 0.20 | |
| Phase thickness (μm) | 0.30 | |
| Tstart (C) | 40. | 50. |
| Tend (C) | 260. | 230. |
| Heat rate (K/min) | 10. | 4. |
| Initial hold (min) | 2. | |
| Final hold (min) | 20. | 10. |
| I | 862. | 813. |
| Reference | Sandoval-Montemayor, Garcia, et al., 2012 | Binder, Turner, et al., 1990 |
| Comment | MSDC-RI | MSDC-RI |
References
Go To: Top, Normal alkane RI, non-polar column, temperature ramp, Notes
Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.
Sandoval-Montemayor, Garcia, et al., 2012
Sandoval-Montemayor, N.E.; Garcia, A.; Elizondo-Trevino, E.; Garza-Gonzales, E.; Alvarez, L.; Camacho-Corona, M. delR.,
Chemical composition of hexane extract of Citrus aurantifolia and anti-mycobacterium tuberculosis activity of some of its constituents,
Molecules, 2012, 17, 12, 11173-11184, https://doi.org/10.3390/molecules170911173
. [all data]
Binder, Turner, et al., 1990
Binder, R.G.; Turner, C.E.; Flath, R.A.,
Volatile components of purple starthistle,
J. Agric. Food Chem., 1990, 38, 4, 1053-1055, https://doi.org/10.1021/jf00094a030
. [all data]
Notes
Go To: Top, Normal alkane RI, non-polar column, temperature ramp, References
- Symbols used in this document:
Tend Final temperature Tstart Initial temperature - Data from NIST Standard Reference Database 69: NIST Chemistry WebBook
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