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3,17-Dimethyl-18,19-dinor-17.alpha.-cholesta-1,3,5,7,9,11,13-heptaene
SpectraBase Compound ID 5jakEfh7EKJ
InChI InChI=1S/C27H34/c1-18(2)7-6-8-20(4)27(5)16-15-25-24-12-10-21-17-19(3)9-11-22(21)23(24)13-14-26(25)27/h9-14,17-18,20H,6-8,15-16H2,1-5H3/t20?,27-/m0/s1
InChIKey OJUUVFJKMJUPIX-OHMHCFLMSA-N
Mol Weight 358.6 g/mol
Molecular Formula C27H34
Exact Mass 358.266051 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3el95IBrVo8
Name 3,17-Dimethyl-18,19-dinor-17.alpha.-cholesta-1,3,5,7,9,11,13-heptaene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H34
InChI InChI=1S/C27H34/c1-18(2)7-6-8-20(4)27(5)16-15-25-24-12-10-21-17-19(3)9-11-22(21)23(24)13-14-26(25)27/h9-14,17-18,20H,6-8,15-16H2,1-5H3/t20?,27-/m0/s1
InChIKey OJUUVFJKMJUPIX-OHMHCFLMSA-N
Molecular Weight 358.569 g/mol
SMILES c12c(c3ccc4c(c3cc2)ccc(C)c4)CC[C@]1(C(CCCC(C)C)C)C
SPLASH splash10-0002-0090000000-2bf32ea10e4444dfdc06
Source of Spectrum PS-50-1742-33
Synonyms (S)-17-(1,5-Dimethyl-hexyl)-3,17-dimethyl-16,17-dihydro-15H-cyclopenta[a]phenanthrene 17-(1,5-dimethylhexyl)-3,17-dimethylgona-1,3,5,7,9,11,13-heptaene
Wiley ID 1347563