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ANDROST-5-ENE-3.BETA.,9-DIOL-7-ONE
SpectraBase Compound ID 24bC9N9sAWW
InChI InChI=1S/C19H28O3/c1-17-6-3-4-14(17)16-15(21)11-12-10-13(20)5-7-18(12,2)19(16,22)9-8-17/h11,13-14,16,20,22H,3-10H2,1-2H3
InChIKey UVPMFSBXBASDQS-UHFFFAOYSA-N
Mol Weight 304.43 g/mol
Molecular Formula C19H28O3
Exact Mass 304.203845 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EGggnF7ZOBZ
Name ANDROST-5-ENE-3.BETA.,9-DIOL-7-ONE
Alternate Name(s) 3,9-DIHYDROXYANDROST-5-EN-7-ONE
CAS Registry Number 58211-38-4
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C19H28O3
InChI InChI=1S/C19H28O3/c1-17-6-3-4-14(17)16-15(21)11-12-10-13(20)5-7-18(12,2)19(16,22)9-8-17/h11,13-14,16,20,22H,3-10H2,1-2H3
InChIKey UVPMFSBXBASDQS-UHFFFAOYSA-N
Nominal Mass 304 u
Owner Database Compilation (C) 2005 Wiley & Sons, Inc.
SMILES C12(O)CCC3(C(CCC3)C1C(C=C1CC(O)CCC21C)=O)C
SPLASH splash10-0f89-4900000000-0c36be1483890d4e8383
Source File Reference LMCM-65523-429Z
Source of Spectrum Copyright (C) Dr. Makin, London Hospital Medical College, UK