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[1S-(1aalpha,4abeta/4aalpha,7alpha,7abeta,7balpha)]-Decahydro-1,7-dimethyl-1-(4-methyl-3-pentenyl)-4-methylen-1H-cycloprop[e]azulene

View entire compound with spectra: 1 MS (GC)

[1S-(1aalpha,4abeta/4aalpha,7alpha,7abeta,7balpha)]-Decahydro-1,7-dimethyl-1-(4-methyl-3-pentenyl)-4-methylen-1H-cycloprop[e]azulene
SpectraBase Compound ID JUuO9VLiXe4
InChI InChI=1S/C20H32/c1-13(2)7-6-12-20(5)17-11-9-14(3)16-10-8-15(4)18(16)19(17)20/h7,15-19H,3,6,8-12H2,1-2,4-5H3/t15-,16?,17-,18-,19-,20+/m1/s1
InChIKey CEHLGENVDATDKI-NODKMMKXSA-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 2z3O6EkrOi
Name [1S-(1aalpha,4abeta/4aalpha,7alpha,7abeta,7balpha)]-Decahydro-1,7-dimethyl-1-(4-methyl-3-pentenyl)-4-methylen-1H-cycloprop[e]azulene
Alternate Name(s) Cneorubin-W1/W2 (1S,1aR,7R,7aR,7bS)-1,7-dimethyl-4-methylene-1-(4-methylpent-3-en-1-yl)decahydro-1H-cyclopropa[e]azulene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H32
InChI InChI=1S/C20H32/c1-13(2)7-6-12-20(5)17-11-9-14(3)16-10-8-15(4)18(16)19(17)20/h7,15-19H,3,6,8-12H2,1-2,4-5H3/t15-,16?,17-,18-,19-,20+/m1/s1
InChIKey CEHLGENVDATDKI-NODKMMKXSA-N
Literature Reference DOI 10.1002/cber.19801131217
Molecular Weight 272.476 g/mol
SMILES [C@]1([C@]2([C@@]3([C@]([C@]3([H])CCC(C2CC1)=C)(CCC=C(C)C)C)[H])[H])(C)[H]
SPLASH splash10-0aos-9510000000-b5d45720945da9130d98
Source of Spectrum K-113-3863-(38/39)
Wiley ID 1794380