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Androst-4-ene-3,17-dione, 19-(2-propenylthio)-
SpectraBase Compound ID 4KfTBqgaYLz
InChI InChI=1S/C22H30O2S/c1-3-12-25-14-22-11-8-16(23)13-15(22)4-5-17-18-6-7-20(24)21(18,2)10-9-19(17)22/h3,13,17-19H,1,4-12,14H2,2H3/t17-,18-,19-,21-,22+/m0/s1
InChIKey MZHQAMJPHONYDX-YOWRRBNZSA-N
Mol Weight 358.54 g/mol
Molecular Formula C22H30O2S
Exact Mass 358.196651 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DytqmSYpDw6
Name Androst-4-ene-3,17-dione, 19-(2-propenylthio)-
Alternate Name(s) 19-(allylsulfanyl)androst-4-ene-3,17-dione 19-Allylthioandrost-4-ene-3,17-dione
CAS Registry Number 90212-22-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H30O2S
InChI InChI=1S/C22H30O2S/c1-3-12-25-14-22-11-8-16(23)13-15(22)4-5-17-18-6-7-20(24)21(18,2)10-9-19(17)22/h3,13,17-19H,1,4-12,14H2,2H3/t17-,18-,19-,21-,22+/m0/s1
InChIKey MZHQAMJPHONYDX-YOWRRBNZSA-N
Molecular Weight 358.540 g/mol
SMILES [C@@]12(C(=CC(CC2)=O)CC[C@]2([C@@]3(CCC([C@]3(CC[C@]12[H])C)=O)[H])[H])CSCC=C
SPLASH splash10-014i-0039000000-594b5d631a8066473306
Source of Spectrum KC-1989-1652-10
Wiley ID 1347276