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ESTRA-1,3,5(10)-TRIENE-3-OL-17-ONE(17-O-METHYLOXIME)
SpectraBase Compound ID cBcoIHN8cP
InChI InChI=1S/C19H25NO2/c1-19-10-9-15-14-6-4-13(21)11-12(14)3-5-16(15)17(19)7-8-18(19)20-22-2/h4,6,11,15-17,21H,3,5,7-10H2,1-2H3/b20-18-
InChIKey PBXZSAMJKKLMEF-ZZEZOPTASA-N
Mol Weight 299.41 g/mol
Molecular Formula C19H25NO2
Exact Mass 299.188529 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1HklnJn1z4n
Name ESTRA-1,3,5(10)-TRIENE-3-OL-17-ONE(17-O-METHYLOXIME)
Alternate Name(s) 3-HYDROXYESTRA-1(10),2,4-TRIEN-17-ONE O-METHYLOXIME
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C19H25NO2
InChI InChI=1S/C19H25NO2/c1-19-10-9-15-14-6-4-13(21)11-12(14)3-5-16(15)17(19)7-8-18(19)20-22-2/h4,6,11,15-17,21H,3,5,7-10H2,1-2H3/b20-18-
InChIKey PBXZSAMJKKLMEF-ZZEZOPTASA-N
Nominal Mass 299 u
Owner Database Compilation (C) 2005 Wiley & Sons, Inc.
SMILES C12(C)CCC3C(CCc4cc(O)ccc34)C2CC\C1=N/OC
SPLASH splash10-014j-2390000000-9dec3c284e348fd039bd
Source File Reference LMCM-41232-457N
Source of Spectrum Copyright (C) Dr. Makin, London Hospital Medical College, UK