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Pregnan-3-ol, 20-methyl-, (3.beta.,5.beta.)-
SpectraBase Compound ID FL42Av37caX
InChI InChI=1S/C22H38O/c1-14(2)18-7-8-19-17-6-5-15-13-16(23)9-11-21(15,3)20(17)10-12-22(18,19)4/h14-20,23H,5-13H2,1-4H3/t15-,16+,17+,18-,19+,20+,21+,22-/m1/s1
InChIKey JUWNKDSIYSVDGY-ABZOQCAJSA-N
Mol Weight 318.5 g/mol
Molecular Formula C22H38O
Exact Mass 318.292266 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B3JDAPRHDiS
Name Pregnan-3-ol, 20-methyl-, (3.beta.,5.beta.)-
CAS Registry Number 72691-61-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H38O
InChI InChI=1S/C22H38O/c1-14(2)18-7-8-19-17-6-5-15-13-16(23)9-11-21(15,3)20(17)10-12-22(18,19)4/h14-20,23H,5-13H2,1-4H3/t15-,16+,17+,18-,19+,20+,21+,22-/m1/s1
InChIKey JUWNKDSIYSVDGY-ABZOQCAJSA-N
Molecular Weight 318.545 g/mol
SMILES O[C@]1(CC[C@@]2([C@]3(CC[C@]4([C@]([C@@]3(CC[C@@]2(C1)[H])[H])(CC[C@@]4(C(C)C)[H])[H])C)[H])C)[H]
SPLASH splash10-0uxr-0019000000-98c9e392d2e31ac04df0
Source of Spectrum F-35-787-0
Synonyms (1S,2S,5S,7R,10R,11S,14R,15R)-2,15-dimethyl-14-(propan-2-yl)tetracyclo[8.7.0.0(2,7).0(11,15)]heptadecan-5-ol 20-Methyl-5.beta.-pregnan-3.beta.-ol
Wiley ID 1319082