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5.alpha.-Androstan-17-one, 3.beta.-hydroxy-, O-methyloxime
SpectraBase Compound ID BIjOTilrz8W
InChI InChI=1S/C20H33NO2/c1-19-10-8-14(22)12-13(19)4-5-15-16-6-7-18(21-23-3)20(16,2)11-9-17(15)19/h13-17,22H,4-12H2,1-3H3/b21-18+
InChIKey MQRMZRCCQGCVFQ-DYTRJAOYSA-N
Mol Weight 319.5 g/mol
Molecular Formula C20H33NO2
Exact Mass 319.251129 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LWQoaFTHoEK
Name 5.BETA.-ANDROSTAN-3.BETA.-OL-17-ONE(17-O-METHYLOXIME)
Alternate Name(s) 3-HYDROXYANDROSTAN-17-ONE O-METHYLOXIME
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C20H33NO2
InChI InChI=1S/C20H33NO2/c1-19-10-8-14(22)12-13(19)4-5-15-16-6-7-18(21-23-3)20(16,2)11-9-17(15)19/h13-17,22H,4-12H2,1-3H3/b21-18+
InChIKey MQRMZRCCQGCVFQ-DYTRJAOYSA-N
Nominal Mass 319 u
Owner Database Compilation (C) 2005 Wiley & Sons, Inc.
SMILES C12(C)CCC(CC2CCC2C1CCC1(C2CC\C1=N\OC)C)O
SPLASH splash10-000i-5490000000-b2cde242fd27e99963ac
Source File Reference LMCM-12208-972U
Source of Spectrum Copyright (C) Dr. Makin, London Hospital Medical College, UK