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(8R,9S,10R,13S,14S,17S)-10,13-dimethyl-2,3,8,9,11,12,14,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-17-ol
SpectraBase Compound ID Jh2vTp4uMo7
InChI InChI=1S/C19H28O/c1-18-11-4-3-5-13(18)6-7-14-15-8-9-17(20)19(15,2)12-10-16(14)18/h5-7,14-17,20H,3-4,8-12H2,1-2H3/t14-,15-,16-,17-,18-,19-/m0/s1
InChIKey VNFTXTNNKNUNFW-DYKIIFRCSA-N
Mol Weight 272.43 g/mol
Molecular Formula C19H28O
Exact Mass 272.214016 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FSs6OQri47y
Name (8R,9S,10R,13S,14S,17S)-10,13-dimethyl-2,3,8,9,11,12,14,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-17-ol
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Exact Mass 272.214015521 u
Formula C19H28O
InChI InChI=1S/C19H28O/c1-18-11-4-3-5-13(18)6-7-14-15-8-9-17(20)19(15,2)12-10-16(14)18/h5-7,14-17,20H,3-4,8-12H2,1-2H3/t14-,15-,16-,17-,18-,19-/m0/s1
InChIKey VNFTXTNNKNUNFW-DYKIIFRCSA-N
Instrument Name Agilent 6890-5973 GC
Ionization Type EI
Literature Reference DOI 10.1002/anie.201706721
Molecular Weight 272.432 g/mol
Quality 1000
SMILES O[C@@]1([C@]2(CC[C@@]3([C@]4(CCCC=C4C=C[C@]3([C@@]2(CC1)[H])[H])C)[H])C)[H]
SPLASH splash10-0abc-3930000000-ceeddce7fd9f841ef526
Source of Spectrum ACI-56-SM25-Figure S18-2 (DOI: 10.1002/anie.201706721)
Wiley ID 1896450