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(3aS,5E,9E,12aS)-1-isopropylidene-3a,6,10-trimethyl-2,3,4,7,8,11,12,12a-octahydrocyclopentacycloundecene
SpectraBase Compound ID 9KjTNCxcQxI
InChI InChI=1S/C20H32/c1-15(2)18-12-14-20(5)13-11-17(4)8-6-7-16(3)9-10-19(18)20/h7,11,19H,6,8-10,12-14H2,1-5H3/b16-7+,17-11+/t19-,20-/m1/s1
InChIKey VSEDLQDFSQWMRG-WSHNDMGWSA-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 3dZjzEkTkIp
Name (3aS,5E,9E,12aS)-1-isopropylidene-3a,6,10-trimethyl-2,3,4,7,8,11,12,12a-octahydrocyclopentacycloundecene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H32
InChI InChI=1S/C20H32/c1-15(2)18-12-14-20(5)13-11-17(4)8-6-7-16(3)9-10-19(18)20/h7,11,19H,6,8-10,12-14H2,1-5H3/b16-7+,17-11+/t19-,20-/m1/s1
InChIKey VSEDLQDFSQWMRG-WSHNDMGWSA-N
Molecular Weight 272.476 g/mol
SMILES C1([C@@]2([C@@](C\C=C\(CC\C=C\(CC2)C)C)(C)CC1)[H])=C(C)C
SPLASH splash10-00dr-0910000000-9cffc7c94f7621cd49f7
Source of Spectrum J-56-3397-4
Synonyms (3aS,5E,9E,12aS)-1-isopropylidene-3a,6,10-trimethyl-2,3,4,7,8,11,12,12a-octahydrocyclopenta[11]annulene (3aS,5E,9E,12aS)-3a,6,10-trimethyl-1-propan-2-ylidene-2,3,4,7,8,11,12,12a-octahydrocyclopenta[11]annulene
Wiley ID 1276868