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5.ALPHA.-ANDROSTAN-16.BETA.-OL-3-ONE(16.BETA.-ACETATE)
SpectraBase Compound ID DHojmrY7JhB
InChI InChI=1S/C21H32O3/c1-13(22)24-16-11-19-17-5-4-14-10-15(23)6-9-21(14,3)18(17)7-8-20(19,2)12-16/h14,16-19H,4-12H2,1-3H3
InChIKey IIDHKRVWBVQTLF-UHFFFAOYSA-N
Mol Weight 332.5 g/mol
Molecular Formula C21H32O3
Exact Mass 332.235145 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7J2K4ccXvAh
Name 5.ALPHA.-ANDROSTAN-16.BETA.-OL-3-ONE(16.BETA.-ACETATE)
Alternate Name(s) 3-OXOANDROSTAN-16-YL ACETATE
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C21H32O3
InChI InChI=1S/C21H32O3/c1-13(22)24-16-11-19-17-5-4-14-10-15(23)6-9-21(14,3)18(17)7-8-20(19,2)12-16/h14,16-19H,4-12H2,1-3H3
InChIKey IIDHKRVWBVQTLF-UHFFFAOYSA-N
Nominal Mass 332 u
Owner Database Compilation (C) 2005 Wiley & Sons, Inc.
SMILES C12(C)CCC(CC2CCC2C1CCC1(C2CC(C1)OC(C)=O)C)=O
SPLASH splash10-0ab9-2290000000-7901dce28f63f08384c4
Source File Reference LMCM-79537-089M
Source of Spectrum Copyright (C) Dr. Makin, London Hospital Medical College, UK