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(+-)-Isocembrene
SpectraBase Compound ID BJ83J9y0c1o
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/h8,11-12,14,16,20H,4,6-7,9-10,13,15H2,1-3,5H3/b14-12+,17-8+,19-11+/t20-/m1/s1
InChIKey VYWGLUCGRVXWKB-OFMMTTMJSA-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 7fQYVER7j8J
Name (+-)-Isocembrene
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/h8,11-12,14,16,20H,4,6-7,9-10,13,15H2,1-3,5H3/b14-12+,17-8+,19-11+/t20-/m1/s1
InChIKey VYWGLUCGRVXWKB-OFMMTTMJSA-N
Molecular Weight 272.476 g/mol
SMILES C1(\C=C\[C@](CC\C(=C\CC\C(=C\CC1)C)C)(C(C)C)[H])=C
SPLASH splash10-03fr-0690000000-91e0a1183b3da4418c38
Source of Spectrum KC-0-60-19
Synonyms (12R)-12-isopropyl-1,5-dimethyl-9-methylene-1,5,10-cyclotetradecatriene
Wiley ID 784812