(E)-β-Famesene

Formula: C₁₅H₂₄
Molecular weight: 204.3511
IUPAC Standard InChI: InChI=1S/C15H24/c1-6-14(4)10-8-12-15(5)11-7-9-13(2)3/h6,9,12H,1,4,7-8,10-11H2,2-3,5H3/b15-12+
IUPAC Standard InChIKey: JSNRRGGBADWTMC-NTCAYCPXSA-N
CAS Registry Number: 18794-84-8
Chemical structure:
This structure is also available as a 2d Mol file or as a computed 3d SD file
The 3d structure may be viewed using Java or Javascript.
Species with the same structure:
Stereoisomers:
Other names: 1,6,10-Dodecatriene, 7,11-dimethyl-3-methylene-, (E)-; 7,11-Dimethyl-3-methylene-1,6,10-dodecatriene, trans; β-Farnesene (E); β-trans-Farnesene; Farnesene (E, β); t-β-Farnesene; trans-β-Farnesene; (6E)-7,11-Dimethyl-3-methylene-1,6,10-dodecatriene; 502-60-3; (E)-β-Farnesene; β-Farnesene; beta-(E)-Farnesene; 7,11-Dimethyl-3-methylene-1,6,10-dodecatriene; trans-β-farnesen; (E)-7,11-dimethyl-3-methylenedodeca-1,6,10-triene
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Van Den Dool and Kratz RI, non-polar column, custom temperature program

Data compiled by: NIST Mass Spectrometry Data Center, William E. Wallace, director

Column type	Capillary	Capillary	Capillary	Capillary	Capillary
Active phase	HP-5MS	BPX-5	DB-5MS	DB-5MS	SE-52
Column length (m)	30.	30.	30.	30.	25.
Carrier gas	He		He	He	He
Substrate
Column diameter (mm)	0.25	0.25	0.25	0.25	0.25
Phase thickness (μm)	0.25	0.25	0.25	0.25	0.25
Program	60C (1 min) => 5 C/min => 210C => 10 C/min => 280C (15 min)	35C(5min) => 3C/min => 210C => 40C/min => 240C (4min)	40 (5min) => 4C/min => 140C => 4C/min => 200C (20min)	40C(5min) => 4C/min => 160C => 8C/min => 240C (15min)	60C(8min) => 3C/min => 180C => 20C/min => 230C
I	1468.5	1467.	1453.	1459.	1455.
Reference	Andriamaharavo, 2014	Cardeal, da Silva, et al., 2006	Zheng, Kim, et al., 2005	Kim, Lee, et al., 2003	Lorenzo, Loayza, et al., 2003
Comment	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI

References

Go To: Top, Van Den Dool and Kratz RI, non-polar column, custom temperature program, Notes

Andriamaharavo, 2014
Andriamaharavo, N.R., Retention Data. NIST Mass Spectrometry Data Center., NIST Mass Spectrometry Data Center, 2014. [all data]

Cardeal, da Silva, et al., 2006
Cardeal, Z.L.; da Silva, M.D.R.G.; Marriott, P.J., Comprehensive two-dimensional gas chromatography/mass spectrometric analysis of pepper volatiles, Rapid Commun. Mass Spectrom., 2006, 20, 19, 2823-2836, https://doi.org/10.1002/rcm.2665 . [all data]

Zheng, Kim, et al., 2005
Zheng, C.H.; Kim, K.H.; Kim, T.H.; Lee, H.J., Analysis and characterization of aroma-active compounds of Schizandra chinensis (omija) leaves, J. Sci. Food Agric., 2005, 85, 1, 161-166, https://doi.org/10.1002/jsfa.1975 . [all data]

Kim, Lee, et al., 2003
Kim, T.H.; Lee, S.M.; Kim, Y.-S.; Kim, K.H.; Oh, S.; Lee, H.J., Aroma dilution method using GC injector split ratio for volatile compounds extracted by headspace solid phase microextraction, Food Chem., 2003, 83, 1, 151-158, https://doi.org/10.1016/S0308-8146(03)00221-8 . [all data]

Lorenzo, Loayza, et al., 2003
Lorenzo, D.; Loayza, I.; Dellacassa, E., Composition of the essential oils from leaves of two Hedyosmum spp. from Bolivia, Flavour Fragr. J., 2003, 18, 1, 32-35, https://doi.org/10.1002/ffj.1146 . [all data]

Notes

Go To: Top, Van Den Dool and Kratz RI, non-polar column, custom temperature program, References

Data from NIST Standard Reference Database 69: NIST Chemistry WebBook
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