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ESTR-4-ENE-17.ALPHA.-ETHYNYL-17.BETA.-OL-3-ONE(3-O-METHYLOXIME)
SpectraBase Compound ID 9mKV31aD2Z9
InChI InChI=1S/C21H29NO2/c1-4-21(23)12-10-19-18-7-5-14-13-15(22-24-3)6-8-16(14)17(18)9-11-20(19,21)2/h1,13,16-19,23H,5-12H2,2-3H3/b22-15-
InChIKey LCSBNAMHSCHNAR-JCMHNJIXSA-N
Mol Weight 327.47 g/mol
Molecular Formula C21H29NO2
Exact Mass 327.219829 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6W960hTKeEG
Name ESTR-4-ENE-17.ALPHA.-ETHYNYL-17.BETA.-OL-3-ONE(3-O-METHYLOXIME)
Alternate Name(s) 17-ETHYNYL-17-HYDROXYESTR-4-EN-3-ONE O-METHYLOXIME
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C21H29NO2
InChI InChI=1S/C21H29NO2/c1-4-21(23)12-10-19-18-7-5-14-13-15(22-24-3)6-8-16(14)17(18)9-11-20(19,21)2/h1,13,16-19,23H,5-12H2,2-3H3/b22-15-
InChIKey LCSBNAMHSCHNAR-JCMHNJIXSA-N
Nominal Mass 327 u
Owner Database Compilation (C) 2005 Wiley & Sons, Inc.
SMILES C12(C)CCC3C(CCC4=C\C(=N/OC)CCC34)C1CCC2(O)C#C
SPLASH splash10-004i-7986000000-0a85f92a42f43c7f71a2
Source File Reference LMCM-76517-716G
Source of Spectrum Copyright (C) Dr. Makin, London Hospital Medical College, UK