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Androst-16-ene-3,11-dione, 17-iodo-, (5.alpha.)-
SpectraBase Compound ID FJLkcLXdCxn
InChI InChI=1S/C19H25IO2/c1-18-8-7-12(21)9-11(18)3-4-13-14-5-6-16(20)19(14,2)10-15(22)17(13)18/h6,11,13-14,17H,3-5,7-10H2,1-2H3/t11-,13-,14-,17+,18-,19-/m0/s1
InChIKey QYWPMYQEAWZPND-XNTXBEAUSA-N
Mol Weight 412.31 g/mol
Molecular Formula C19H25IO2
Exact Mass 412.089925 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IULfDQ9CJkL
Name Androst-16-ene-3,11-dione, 17-iodo-, (5.alpha.)-
Alternate Name(s) (5alpha)-17-iodoandrost-16-ene-3,11-dione 17-Iodoandrost-16-ene-3,11-dione
CAS Registry Number 117572-15-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H25IO2
InChI InChI=1S/C19H25IO2/c1-18-8-7-12(21)9-11(18)3-4-13-14-5-6-16(20)19(14,2)10-15(22)17(13)18/h6,11,13-14,17H,3-5,7-10H2,1-2H3/t11-,13-,14-,17+,18-,19-/m0/s1
InChIKey QYWPMYQEAWZPND-XNTXBEAUSA-N
Molecular Weight 412.311 g/mol
SMILES [C@@]12([C@]([C@@]3(CC[C@@]4([C@@]([C@]3(C(C2)=O)[H])(CCC(=O)C4)C)[H])[H])(CC=C1I)[H])C
SPLASH splash10-03kd-6923300000-d1c0ffe7a0f46668020f
Source of Spectrum KC-1988-1656-10
Wiley ID 1374310