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Pregnan-18-ol, (5.alpha.)-
SpectraBase Compound ID CKBjxoEfYf8
InChI InChI=1S/C21H36O/c1-3-15-8-10-19-17-9-7-16-6-4-5-12-20(16,2)18(17)11-13-21(15,19)14-22/h15-19,22H,3-14H2,1-2H3
InChIKey JJAVIDNFZQKRMB-UHFFFAOYSA-N
Mol Weight 304.5 g/mol
Molecular Formula C21H36O
Exact Mass 304.276616 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KJYWFPkXbUG
Name Pregnan-18-ol, (5.alpha.)-
CAS Registry Number 56053-09-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H36O
InChI InChI=1S/C21H36O/c1-3-15-8-10-19-17-9-7-16-6-4-5-12-20(16,2)18(17)11-13-21(15,19)14-22/h15-19,22H,3-14H2,1-2H3
InChIKey JJAVIDNFZQKRMB-UHFFFAOYSA-N
Molecular Weight 304.518 g/mol
SMILES OCC12C(C3C(CC2)C2(C)C(CC3)CCCC2)CCC1CC
SPLASH splash10-06ea-9720000000-ca34fd92545af905d038
Source of Spectrum SD-1981-0-0
Synonyms Pregnan-18-ol (17-ethyl-10-methyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-13-yl)methanol
Wiley ID 1307031