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5.alpha.-Androstan-16-one, cyclic ethylene mercaptole
SpectraBase Compound ID 5Qc14ywIZu5
InChI InChI=1S/C21H34S2/c1-19-10-8-17-16(7-6-15-5-3-4-9-20(15,17)2)18(19)13-21(14-19)22-11-12-23-21/h15-18H,3-14H2,1-2H3
InChIKey ZOLPVFXOXCUNAF-UHFFFAOYSA-N
Mol Weight 350.6 g/mol
Molecular Formula C21H34S2
Exact Mass 350.210193 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DkgmKgMzGjZ
Name 5.alpha.-Androstan-16-one, cyclic ethylene mercaptole
CAS Registry Number 2759-86-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H34S2
InChI InChI=1S/C21H34S2/c1-19-10-8-17-16(7-6-15-5-3-4-9-20(15,17)2)18(19)13-21(14-19)22-11-12-23-21/h15-18H,3-14H2,1-2H3
InChIKey ZOLPVFXOXCUNAF-UHFFFAOYSA-N
Molecular Weight 350.623 g/mol
SMILES CC12CC3(SCCS3)CC1C1C(CC2)C2(C)C(CC1)CCCC2
SPLASH splash10-0aou-9100000000-15997632719d90538f01
Source of Spectrum SD-1981-0-0
Synonyms 10,13-dimethylspiro[1,2,3,4,5,6,7,8,9,11,12,14,15,17-tetradecahydrocyclopenta[a]phenanthrene-16,2'-1,3-dithiolane]
Wiley ID 1342177