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(3Z)-Cembrene A
SpectraBase Compound ID 8oM4lO4NJ7K
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-IOBQTAGVSA-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 5MFS6ccYyjN
Name (3Z)-Cembrene A
Alternate Name(s) 12-isopropenyl-1,5,9-trimethyl-1,5,9-cyclotetradecatriene
CAS Registry Number 71213-92-8
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-IOBQTAGVSA-N
Molecular Weight 272.476 g/mol
SMILES C(C1C\C=C/(CC\C=C\(CC\C=C\(CC1)C)C)C)(=C)C
SPLASH splash10-014l-9200000000-15adef5cd29643d3cce0
Source of Spectrum J-44-3951-0
Wiley ID 1276786