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ABIETA-8,13(15)-DIENE

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ABIETA-8,13(15)-DIENE
SpectraBase Compound ID 1vHOTtqFvBl
InChI InChI=1S/C20H32/c1-14(2)15-7-9-17-16(13-15)8-10-18-19(3,4)11-6-12-20(17,18)5/h18H,6-13H2,1-5H3/t18-,20+/m0/s1
InChIKey XVRKAXNTAQLILL-AZUAARDMSA-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 AMrtkaeNZxF
Name (4bS,8aS)-2-isopropylidene-4b,8,8-trimethyl-3,4,5,6,7,8a,9,10-octahydro-1H-phenanthrene
CAS Registry Number 105405-30-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H32
InChI InChI=1S/C20H32/c1-14(2)15-7-9-17-16(13-15)8-10-18-19(3,4)11-6-12-20(17,18)5/h18H,6-13H2,1-5H3/t18-,20+/m0/s1
InChIKey XVRKAXNTAQLILL-AZUAARDMSA-N
Molecular Weight 272.476 g/mol
SMILES C=12[C@@]3([C@@](C(C)(C)CCC3)([H])CCC1CC(CC2)=C(C)C)C
SPLASH splash10-0006-9300000000-2b0730f6462b97b15c06
Source of Spectrum Va-0-0-0
Synonyms (4bS,8aS)-4b,8,8-trimethyl-2-propan-2-ylidene-3,4,5,6,7,8a,9,10-octahydro-1H-phenanthrene
Wiley ID 742760