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Androstane-3,6,17-trione
SpectraBase Compound ID CNdM2BacpJI
InChI InChI=1S/C19H26O3/c1-18-7-5-11(20)9-15(18)16(21)10-12-13-3-4-17(22)19(13,2)8-6-14(12)18/h12-15H,3-10H2,1-2H3
InChIKey MGUDNDBPVZPSQA-UHFFFAOYSA-N
Mol Weight 302.41 g/mol
Molecular Formula C19H26O3
Exact Mass 302.188195 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4UsdSgS9Pe
Name 5.ALPHA.-ANDROSTANE-3,6,17-TRIONE
Alternate Name(s) ANDROSTANE-3,6,17-TRIONE
CAS Registry Number 2243-05-2
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C19H26O3
InChI InChI=1S/C19H26O3/c1-18-7-5-11(20)9-15(18)16(21)10-12-13-3-4-17(22)19(13,2)8-6-14(12)18/h12-15H,3-10H2,1-2H3
InChIKey MGUDNDBPVZPSQA-UHFFFAOYSA-N
Nominal Mass 302 u
Owner Database Compilation (C) 2005 Wiley & Sons, Inc.
SMILES C12(C)CCC(CC2C(CC2C3C(C)(C(CC3)=O)CCC12)=O)=O
SPLASH splash10-0udi-9454000000-b125f841710185a38d6c
Source File Reference LMCM-62842-185B
Source of Spectrum Copyright (C) Dr. Makin, London Hospital Medical College, UK