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Androstane-2,11-dione, cyclic 2-(1,2-ethanediyl mercaptole), (5.alpha.)-
SpectraBase Compound ID 7qDavhJsqTe
InChI InChI=1S/C21H32OS2/c1-19-8-3-4-16(19)15-6-5-14-7-9-21(23-10-11-24-21)13-20(14,2)18(15)17(22)12-19/h14-16,18H,3-13H2,1-2H3
InChIKey MUPYVMYIYBFMJW-UHFFFAOYSA-N
Mol Weight 364.6 g/mol
Molecular Formula C21H32OS2
Exact Mass 364.189458 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID I6pIfRv8wt5
Name Androstane-2,11-dione, cyclic 2-(1,2-ethanediyl mercaptole), (5.alpha.)-
CAS Registry Number 54498-87-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H32OS2
InChI InChI=1S/C21H32OS2/c1-19-8-3-4-16(19)15-6-5-14-7-9-21(23-10-11-24-21)13-20(14,2)18(15)17(22)12-19/h14-16,18H,3-13H2,1-2H3
InChIKey MUPYVMYIYBFMJW-UHFFFAOYSA-N
Molecular Weight 364.606 g/mol
SMILES C12(C)C3C(C4C(CC3=O)(C)CCC4)CCC2CCC2(C1)SCCS2
SPLASH splash10-001i-6923000000-74c02478072d40e13956
Source of Spectrum SD-1981-0-0
Synonyms 10',13'-dimethyl-11'-spiro[1,3-dithiolane-2,2'-3,4,5,6,7,8,9,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthrene]one 10',13'-dimethylspiro[1,3-dithiolane-2,2'-3,4,5,6,7,8,9,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthrene]-11'-one
Wiley ID 1350872