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Clostebol -HCl AC
SpectraBase Compound ID G5yRjdDxoo9
InChI InChI=1S/C21H28O3/c1-13(22)24-19-7-6-17-16-5-4-14-12-15(23)8-10-20(14,2)18(16)9-11-21(17,19)3/h8,10,12,16-19H,4-7,9,11H2,1-3H3
InChIKey KPCDGGNHYODURF-UHFFFAOYSA-N
Mol Weight 328.45 g/mol
Molecular Formula C21H28O3
Exact Mass 328.203845 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AbD9hq6pEOj
Name ANDROSTA-1,4-DIENE-17.BETA.-OL-3-ONE(17.BETA.-ACETATE)
Alternate Name(s) 3-OXOANDROSTA-1,4-DIEN-17-YL ACETATE
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C21H28O3
InChI InChI=1S/C21H28O3/c1-13(22)24-19-7-6-17-16-5-4-14-12-15(23)8-10-20(14,2)18(16)9-11-21(17,19)3/h8,10,12,16-19H,4-7,9,11H2,1-3H3
InChIKey KPCDGGNHYODURF-UHFFFAOYSA-N
Nominal Mass 328 u
Owner Database Compilation (C) 2005 Wiley & Sons, Inc.
SMILES C12(C)C=CC(C=C2CCC2C1CCC1(C2CCC1OC(C)=O)C)=O
SPLASH splash10-00fv-4910000000-456ed8193278577154e3
Source File Reference LMCM-76076-943N
Source of Spectrum Copyright (C) Dr. Makin, London Hospital Medical College, UK