(E)-1-Methyl-4-(6-methylhept-5-en-2-ylidene)cyclohex-1-ene
- Formula: C15H24
- Molecular weight: 204.3511
- IUPAC Standard InChI: InChI=1S/C15H24/c1-12(2)6-5-7-14(4)15-10-8-13(3)9-11-15/h6,8H,5,7,9-11H2,1-4H3/b15-14-
- IUPAC Standard InChIKey: XBGUIVFBMBVUEG-PFONDFGASA-N
- CAS Registry Number: 53585-13-0
- Chemical structure:
This structure is also available as a 2d Mol file - Stereoisomers:
- Other names: Cyclohexene, 4-(1,5-dimethyl-4-hexen-1-ylidene)-1-methyl-, (E)-; Cyclohexene, 4-(1,5-dimethyl-4-hexenylidene)-1-methyl-, (E)-; (E)-γ-Bisabolene; trans-γ-Bisabolene; γ-Bisabolene; γ-E-Bisabolene; (E)-iso-γ-Bisabolene
- Permanent link for this species. Use this link for bookmarking this species for future reference.
- Information on this page:
- Other data available:
- Options:
Normal alkane 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 | Capillary | Capillary | Capillary |
|---|---|---|---|---|---|
| Active phase | DB-5 | HP-5 | SLB-5 MS | HP-5 MS | DB-5 |
| Column length (m) | 30. | 30. | 30. | 30. | 30. |
| Carrier gas | Helium | Helium | Helium | He | |
| Substrate | |||||
| Column diameter (mm) | 0.25 | 0.32 | 0.25 | 0.25 | 0.25 |
| Phase thickness (μm) | 0.25 | 0.25 | 0.25 | ||
| Program | 50 0C m6 0C/min -> 140 0C 5 0C/min -> 160 0C (1 min) 10 0C/min -> 200 0C | not specified | not specified | 40 0C (10 min) 3 oC/min -> 200 0C 2 0C/min -> 220 0C | 35C => 4C/min => 180C => 10C/min => 250C |
| I | 1529. | 1533. | 1531. | 1539. | 1537. |
| Reference | Courtois, Paine, et al., 2009 | Riahi, Pourbasheer, et al., 2009 | Lo Presti, Sciarrone, et al., 2008 | Setzer, Stokes, et al., 2007 | Albuquerque, Canuto, et al., 2006 |
| Comment | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI |
| Column type | Capillary | Capillary | Capillary | Capillary |
|---|---|---|---|---|
| Active phase | VF-5MS | HP-5 | SE-30 | Methyl Silicone |
| Column length (m) | 30. | 30. | ||
| Carrier gas | He | |||
| Substrate | ||||
| Column diameter (mm) | 0.25 | 0.32 | ||
| Phase thickness (μm) | 0.25 | |||
| Program | 40C(1min) => 15C/min => 100C => 4C/min => 250C (1min) | 65C(1min) => 1C/min => 75C (2min) => 0.5C/min => 81C(2min) => 3C/min => 180C(7min) | not specified | not specified |
| I | 1577. | 1535. | 1528. | 1528. |
| Reference | Xie, Sun, et al., 2006 | Singh, Maurya, et al., 2005 | Vinogradov, 2004 | Zenkevich, 1996 |
| Comment | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI |
References
Go To: Top, Normal alkane 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.
Courtois, Paine, et al., 2009
Courtois, E.A.; Paine, C.E.; Blandinieres, P.-A.; Stien, D.; Bessiere, J.-M.; Houel, E.; Baraloto, C.; Chave, J.,
Diversity of the volatile organic compounds emitted by 55 species of tropical trees: a survey in French Guiana,
J. Chem. Ecol., 2009, 35, 11, 1349-1362, https://doi.org/10.1007/s10886-009-9718-1
. [all data]
Riahi, Pourbasheer, et al., 2009
Riahi, S.; Pourbasheer, E.; Ganjali, M.R.; Norouzi, P.,
Investigation of different linear and non-linear chemometric methods for modeling of retention index of essential oil components: Concerns to support vector mashine,
J. Hazard. Mat., 2009, 166, 2-3, 853-859, https://doi.org/10.1016/j.jhazmat.2008.11.097
. [all data]
Lo Presti, Sciarrone, et al., 2008
Lo Presti, M.; Sciarrone, D.; Crupi, M.C.; Costa, R.; Ragusa, S.; Dugo, G.; Mondello, L.,
Evaliation of the volatile and chiral composition in Pistacia lentiscus L. essential oil,
Flavour Fragr. J., 2008, 23, 4, 249-257, https://doi.org/10.1002/ffj.1878
. [all data]
Setzer, Stokes, et al., 2007
Setzer, W.N.; Stokes, S.L.; Penton, A.F.; Takaku, S.; Haber, W.A.; Hansell, E.; Caffrey, C.R.; McKerrow, J.H.,
Cruzain inhibitory activity of leaf essential oils of neotropical Lauraceae and essential oil components,
Natural Product Communications, 2007, 2, 12, 1203-1210. [all data]
Albuquerque, Canuto, et al., 2006
Albuquerque, M.R.J.R.; Canuto, K.M.; Pessoa, O.D.L.; Nunes, E.P.; Nascimento, R.F.; Silveira, E.R.,
Essential oil composition of Verbesina diversifolia DC,
Flavour Fragr. J., 2006, 21, 4, 634-636, https://doi.org/10.1002/ffj.1632
. [all data]
Xie, Sun, et al., 2006
Xie, J.; Sun, B.; Yu, M.,
Constituents of top fragrance from fresh flowers of Robinia Pseudoacacia L. occurring in China,
Flavour Fragr. J., 2006, 21, 5, 798-800, https://doi.org/10.1002/ffj.1720
. [all data]
Singh, Maurya, et al., 2005
Singh, G.; Maurya, S.; Catalan, C.; de Lampasona, M.P.,
Studies on essential oils, Part 42: chemical, antifungal, antioxidant and sprout suppressant studies on ginger essential oil and its oleoresin,
Flavour Fragr. J., 2005, 20, 1, 1-6, https://doi.org/10.1002/ffj.1373
. [all data]
Vinogradov, 2004
Vinogradov, B.A.,
Production, composition, properties and application of essential oils, 2004, retrieved from http://viness.narod.ru. [all data]
Zenkevich, 1996
Zenkevich, I.G.,
Analytical Parameters of Components of Essential Oils for their Chromatographic and Chromato-Mass Spectral Identification. Mono- and Sesquiterpenes,
Rastitelnye Resursy (Plant resources), 1996, 34, 1-2, 48-58. [all data]
Notes
Go To: Top, Normal alkane RI, non-polar column, custom temperature program, References
- Data from NIST Standard Reference Database 69: NIST Chemistry WebBook
- The National Institute of Standards and Technology (NIST) uses its best efforts to deliver a high quality copy of the Database and to verify that the data contained therein have been selected on the basis of sound scientific judgment. However, NIST makes no warranties to that effect, and NIST shall not be liable for any damage that may result from errors or omissions in the Database.
- Customer support for NIST Standard Reference Data products.