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11-Thia-5.beta.,9.beta.-pregnan-3.alpha.-ol
SpectraBase Compound ID FlHh06usNz6
InChI InChI=1S/C20H34OS/c1-4-13-6-8-17-16-7-5-14-11-15(21)9-10-19(14,2)18(16)22-12-20(13,17)3/h13-18,21H,4-12H2,1-3H3/t13?,14-,15-,16?,17?,18-,19+,20?/m1/s1
InChIKey CAQMREXJUBOUEW-VRGBHMEZSA-N
Mol Weight 322.6 g/mol
Molecular Formula C20H34OS
Exact Mass 322.233037 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8At0JCrCIFa
Name 11-thia-5.beta.,9.beta.-pregnan-3.alpha.-ol
CAS Registry Number 125409-27-0
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H34OS
InChI InChI=1S/C20H34OS/c1-4-13-6-8-17-16-7-5-14-11-15(21)9-10-19(14,2)18(16)22-12-20(13,17)3/h13-18,21H,4-12H2,1-3H3/t13?,14-,15-,16?,17?,18-,19+,20?/m1/s1
InChIKey CAQMREXJUBOUEW-VRGBHMEZSA-N
Molecular Weight 322.551 g/mol
SMILES O[C@@]1(CC[C@@]2([C@@]3(SCC4(C(C3CC[C@@]2(C1)[H])CCC4CC)C)[H])C)[H]
SPLASH splash10-0fk9-0009000000-0b890dbebb10322fb41b
Source of Spectrum J-55-2176-43
Synonyms (2R,4aS,4bR,11aR)-7-ethyl-4a,6a-dimethylhexadecahydrocyclopenta[d]naphtho[1,2-b]thiopyran-2-ol
Wiley ID 1322008