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5.alpha.-androstan-3,11-dione 3-ethylene thioketal
SpectraBase Compound ID BrsidgA9aOu
InChI InChI=1S/C21H32OS2/c1-19-7-3-4-16(19)15-6-5-14-12-21(23-10-11-24-21)9-8-20(14,2)18(15)17(22)13-19/h14-16,18H,3-13H2,1-2H3/t14-,15-,16-,18+,19-,20-/m0/s1
InChIKey ASVMXASRHWCKMW-YZOVGUKHSA-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 15qH414b13v
Name 5.alpha.-androstan-3,11-dione 3-ethylene thioketal
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H32OS2
InChI InChI=1S/C21H32OS2/c1-19-7-3-4-16(19)15-6-5-14-12-21(23-10-11-24-21)9-8-20(14,2)18(15)17(22)13-19/h14-16,18H,3-13H2,1-2H3/t14-,15-,16-,18+,19-,20-/m0/s1
InChIKey ASVMXASRHWCKMW-YZOVGUKHSA-N
Molecular Weight 364.606 g/mol
SMILES [C@@]12([C@@]3([C@@](CC4(CC3)SCCS4)([H])CC[C@]2([C@@]2(CCC[C@]2(CC1=O)C)[H])[H])C)[H]
SPLASH splash10-02ai-2913000000-230eea3953d6e3ac7d42
Source of Spectrum V-2-479-2
Synonyms (1'S,2'S,7'S,10'S,11'S,15'S)-2',15'-dimethylspiro[1,3-dithiolane-2,5'-tetracyclo[8.7.0.0(2,7).0(11,15)]heptadecane]-17'-one
Wiley ID 1350873