Bicyclo[3.1.1]hept-2-ene, 2,6-dimethyl-6-(4-methyl-3-pentenyl)-
- Formula: C15H24
- Molecular weight: 204.3511
- IUPAC Standard InChI: InChI=1S/C15H24/c1-11(2)6-5-9-15(4)13-8-7-12(3)14(15)10-13/h6-7,13-14H,5,8-10H2,1-4H3
- IUPAC Standard InChIKey: YMBFCQPIMVLNIU-UHFFFAOYSA-N
- CAS Registry Number: 17699-05-7
- Chemical structure:
This structure is also available as a 2d Mol file - Species with the same structure:
- Stereoisomers:
- Other names: 2-Norpinene, 2,6-dimethyl-6-(4-methyl-3-pentenyl)-; α-Bergamotene; trans-α-Bergamotene; Bicyclo[3,1,1]hept-2-ene,2,6-dimethyl-6-[4-methyl-3-pentenyl]-; 2,6-dimethyl-6-(4-methyl-3-pentenyl)bicyclo[3.1.1]hept-2-ene
- Information on this page:
- Other data available:
- Options:
Kovats' RI, non-polar column, custom temperature program
Go To: Top, 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
| Column type | Capillary | Capillary | Packed |
|---|---|---|---|
| Active phase | BP-1 | BP-1 | SE-30 |
| Column length (m) | 25. | 30. | 6.1 |
| Carrier gas | N2 | N2 | He |
| Substrate | Chromasorb W | ||
| Column diameter (mm) | 0.25 | 0.32 | |
| Phase thickness (μm) | 0.25 | 0.25 | |
| Program | 60C => 5C/min => 220C (5min) => 3C/min => 245 C (5min) | 60 C 5 C/min -> 220 C (5 min) 3 C/min -> 245 C (5 min) | 150C (10min) => 15C/min => 200C(16min) => 10C/min => 240C |
| I | 1440. | 1440. | 1460. |
| Reference | Khan, Srivastava, et al., 2003 | Khan, Srivastava, et al., 2002 | Minyard, Tumlinson, et al., 1967 |
| Comment | MSDC-RI | MSDC-RI | MSDC-RI |
References
Go To: Top, Kovats' RI, non-polar column, custom temperature program, Notes
Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.
Khan, Srivastava, et al., 2003
Khan, M.; Srivastava, S.K.; Jain, N.; Syamasundar, K.V.; Yadav, A.K.,
Chemical composition of fruit and stem essential oils of Lantana camara from northern India,
Flavour Fragr. J., 2003, 18, 5, 376-379, https://doi.org/10.1002/ffj.1197
. [all data]
Khan, Srivastava, et al., 2002
Khan, M.; Srivastava, S.K.; Syamasundar, K.V.; Singh, M.; Naqvi, A.A.,
Chemical composition of leaf and flower essential oil of Lantana camara from India,
Flavour Fragr. J., 2002, 17, 1, 75-77, https://doi.org/10.1002/ffj.1047
. [all data]
Minyard, Tumlinson, et al., 1967
Minyard, J.P.; Tumlinson, J.H.; Thompson, A.C.; Hedin, P.A.,
Constituents of the cotton bud. The carbonyl compounds,
J. Agric. Food Chem., 1967, 15, 3, 517-524, https://doi.org/10.1021/jf60151a021
. [all data]
Notes
Go To: Top, Kovats' RI, non-polar column, custom temperature program, References
- Data from NIST Standard Reference Database 69: NIST Chemistry WebBook
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