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(4aR,4bS,8aS)-1-isopropyl-4b,8,8-trimethyl-4,4a,5,6,7,8a,9,10-octahydro-3H-phenanthren-2-one
SpectraBase Compound ID JiuCFYmPObH
InChI InChI=1S/C20H32O/c1-13(2)18-14-7-10-17-19(3,4)11-6-12-20(17,5)15(14)8-9-16(18)21/h13,15,17H,6-12H2,1-5H3/t15-,17-,20+/m0/s1
InChIKey CAVUJJCKTDFVCI-RIFZZMRRSA-N
Mol Weight 288.5 g/mol
Molecular Formula C20H32O
Exact Mass 288.245316 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CFSwaQ4XQ7N
Name (4aR,4bS,8aS)-1-isopropyl-4b,8,8-trimethyl-4,4a,5,6,7,8a,9,10-octahydro-3H-phenanthren-2-one
Appearance Orange oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H32O
InChI InChI=1S/C20H32O/c1-13(2)18-14-7-10-17-19(3,4)11-6-12-20(17,5)15(14)8-9-16(18)21/h13,15,17H,6-12H2,1-5H3/t15-,17-,20+/m0/s1
InChIKey CAVUJJCKTDFVCI-RIFZZMRRSA-N
Instrument Name Hewlett Packard 5890-5972 or Agilent 6890N-5973N
Ionization Type EI
Literature Reference DOI 10.3998/ark.5550190.0013.313
Molecular Weight 288.475 g/mol
SMILES C1C[C@]2([C@](CCC=3[C@@]2(CCC(C3C(C)C)=O)[H])([H])C(C)(C)C1)C
SPLASH splash10-000i-0930000000-b61938b70bd437b854dd
Source of Spectrum ARK-2012-179-11
Thin-Layer Chromatography Rf = 0.49 (pentane/EtOAc, 10:1)
Wiley ID 1864545