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4,8,12-TRIMETHYL-1-(1-METHYLETHENYL)-3,7,11-CYCLOTETRADECATRIENE;CEMBRENE-A
SpectraBase Compound ID ISSxjiPPhg6
InChI InChI=1S/C20H32/c1-16(2)20-14-12-18(4)10-6-8-17(3)9-7-11-19(5)13-15-20/h8,11-12,20H,1,6-7,9-10,13-15H2,2-5H3/b17-8-,18-12-,19-11-
InChIKey VWSPQDDPRITBAM-XBMWAWDJSA-N
Mol Weight 272.5 g/mol
Molecular Formula C20H32
Exact Mass 272.250401 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FBLfO6RaVkj
Name (3e,7e,11e)-cembra-3,7,11,15-tetraene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H32
InChI InChI=1S/C20H32/c1-16(2)20-14-12-18(4)10-6-8-17(3)9-7-11-19(5)13-15-20/h8,11-12,20H,1,6-7,9-10,13-15H2,2-5H3/b17-8-,18-12-,19-11-
InChIKey VWSPQDDPRITBAM-XBMWAWDJSA-N
Ionization Type EI-B
Molecular Weight 272.476 g/mol
SMILES C\C=1CC\C=C/(CCC(C\C=C/(CCC/1)C)C(C)=C)C
SPLASH splash10-05nf-9710000000-64bd9a0c8854f5caffe8
Source of Spectrum SRH-2022-10632-0
Synonyms Cembrene-a
Wiley ID 1832245