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5.alpha.-Cholestan-19-ol, 1.beta.-chloro-
SpectraBase Compound ID 6yRktltoqHp
InChI InChI=1S/C27H47ClO/c1-18(2)7-5-8-19(3)22-13-14-23-21-12-11-20-9-6-10-25(28)27(20,17-29)24(21)15-16-26(22,23)4/h18-25,29H,5-17H2,1-4H3
InChIKey XVOXRLIWLUHERU-UHFFFAOYSA-N
Mol Weight 423.1 g/mol
Molecular Formula C27H47ClO
Exact Mass 422.331544 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DCF0Vcf9TZU
Name 5.alpha.-Cholestan-19-ol, 1.beta.-chloro-
CAS Registry Number 28809-52-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H47ClO
InChI InChI=1S/C27H47ClO/c1-18(2)7-5-8-19(3)22-13-14-23-21-12-11-20-9-6-10-25(28)27(20,17-29)24(21)15-16-26(22,23)4/h18-25,29H,5-17H2,1-4H3
InChIKey XVOXRLIWLUHERU-UHFFFAOYSA-N
Molecular Weight 423.125 g/mol
SMILES OCC12C3C(C4C(CC3)(C)C(C(CCCC(C)C)C)CC4)CCC2CCCC1Cl
SPLASH splash10-0076-0029400000-5f30623984af64cea599
Source of Spectrum O-4-374-3
Synonyms 1-Chlorocholestan-19-ol [1-chloranyl-13-methyl-17-(6-methylheptan-2-yl)-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-10-yl]methanol [1-chloro-13-methyl-17-(6-methylheptan-2-yl)-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-10-yl]methanol [1-chloro-17-(1,5-dimethylhexyl)-13-methyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-10-yl]methanol
Wiley ID 1378781