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3-Chloro-17-(1,5-dimethylhexyl)-10,13-dimethyl-2,3,4,7,8,9,10,11,12,13,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthrene
SpectraBase Compound ID CVLqvTzS3CD
InChI InChI=1S/C27H45Cl/c1-18(2)7-6-8-19(3)23-11-12-24-22-10-9-20-17-21(28)13-15-26(20,4)25(22)14-16-27(23,24)5/h9,18-19,21-25H,6-8,10-17H2,1-5H3
InChIKey OTVRYZXVVMZHHW-UHFFFAOYSA-N
Mol Weight 405.1 g/mol
Molecular Formula C27H45Cl
Exact Mass 404.320979 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2bd7PX9wPmG
Name 3-Chloro-17-(1,5-dimethylhexyl)-10,13-dimethyl-2,3,4,7,8,9,10,11,12,13,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthrene
CAS Registry Number 910-31-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H45Cl
InChI InChI=1S/C27H45Cl/c1-18(2)7-6-8-19(3)23-11-12-24-22-10-9-20-17-21(28)13-15-26(20,4)25(22)14-16-27(23,24)5/h9,18-19,21-25H,6-8,10-17H2,1-5H3
InChIKey OTVRYZXVVMZHHW-UHFFFAOYSA-N
Molecular Weight 405.110 g/mol
SMILES CC12C(C3C(C4(C)C(CC(CC4)Cl)=CC3)CC1)CCC2C(CCCC(C)C)C
SPLASH splash10-0f6x-7084900000-0d8a3f5052d4ce80f7c0
Source of Spectrum U-1995-1875-8
Synonyms 3-Chlorocholest-5-ene 3-Chloro-17-(1,5-dimethyl-hexyl)-10,13-dimethyl-2,3,4,7,8,9,10,11,12,13,14,15,16 3-Chloro-5-cholestene 3-Chloranyl-10,13-dimethyl-17-(6-methylheptan-2-yl)-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthrene 3-Chloro-10,13-dimethyl-17-(6-methylheptan-2-yl)-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthrene 3-Chloro-17-(1,5-dimethylhexyl)-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthrene 3-Chlorocholestene 5-Cholesten-3.beta.-chloride Cholest-5-ene, 3-chloro-, (3.beta.)- Cholest-5-ene, 3-chloro-, (3beta)- Cholest-5-ene, 3.beta.-chloro- Cholesterol chloride Cholesteryl chloride AI3-24122 EINECS 213-004-4 NSC 2084
Wiley ID 820123