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Androstan-3-one, cyclic 1,2-ethanediyl mercaptole, (5.alpha.)-
SpectraBase Compound ID AuW5PjkndCK
InChI InChI=1S/C21H34S2/c1-19-8-3-4-17(19)16-6-5-15-14-21(22-12-13-23-21)11-10-20(15,2)18(16)7-9-19/h15-18H,3-14H2,1-2H3
InChIKey YNVILHLADMIWHU-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 DMo5njZJzJB
Name Androstan-3-one, cyclic 1,2-ethanediyl mercaptole, (5.alpha.)-
Alternate Name(s) 10,13-dimethylspiro[1,2,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthrene-3,2'-1,3-dithiolane]
CAS Registry Number 2791-42-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H34S2
InChI InChI=1S/C21H34S2/c1-19-8-3-4-17(19)16-6-5-15-14-21(22-12-13-23-21)11-10-20(15,2)18(16)7-9-19/h15-18H,3-14H2,1-2H3
InChIKey YNVILHLADMIWHU-UHFFFAOYSA-N
Molecular Weight 350.623 g/mol
SMILES CC12CCCC2C2CCC3CC4(CCC3(C2CC1)C)SCCS4
SPLASH splash10-0006-9610000000-580bc4069a0dbe964588
Source of Spectrum SD-1981-0-0
Wiley ID 51993