Androst-4-ene-3,17-dione, 19-[(methylsulfonyl)thio]-

SpectraBase Compound ID	DJw22jxJI4b
InChI	InChI=1S/C20H28O4S2/c1-19-9-8-17-15(16(19)5-6-18(19)22)4-3-13-11-14(21)7-10-20(13,17)12-25-26(2,23)24/h11,15-17H,3-10,12H2,1-2H3/t15-,16-,17-,19-,20+/m0/s1
InChIKey	AXIOBUDOLPICSY-VDWQKOAOSA-N Google Search
Mol Weight	396.56 g/mol
Molecular Formula	C20H28O4S2
Exact Mass	396.142902 g/mol

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SpectraBase Spectrum ID	AXduYkl0Lno
Name	Androst-4-ene-3,17-dione, 19-[(methylsulfonyl)thio]-
Alternate Name(s)	19-Methylsulphonylthioandrost-4-ene-3,17-dione S-(3,17-dioxoandrost-4-en-19-yl) methanesulfonothioate
CAS Registry Number	102035-74-5
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C20H28O4S2
InChI	InChI=1S/C20H28O4S2/c1-19-9-8-17-15(16(19)5-6-18(19)22)4-3-13-11-14(21)7-10-20(13,17)12-25-26(2,23)24/h11,15-17H,3-10,12H2,1-2H3/t15-,16-,17-,19-,20+/m0/s1
InChIKey	AXIOBUDOLPICSY-VDWQKOAOSA-N
Molecular Weight	396.560 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])CSS(=O)(=O)C
SPLASH	splash10-014i-0039000000-9486ab3c3db481696e7f
Source of Spectrum	KC-1989-1654-10
Wiley ID	1367371