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ESTRA-1,3,5(10)-TRIENE-7.ALPHA.-METHYL-3,17.BETA.-DIOL
SpectraBase Compound ID 7YFq79tsQXh
InChI InChI=1S/C19H26O2/c1-11-9-12-10-13(20)3-4-14(12)15-7-8-19(2)16(18(11)15)5-6-17(19)21/h3-4,10-11,15-18,20-21H,5-9H2,1-2H3
InChIKey DXWWYJWUFULMAP-UHFFFAOYSA-N
Mol Weight 286.41 g/mol
Molecular Formula C19H26O2
Exact Mass 286.19328 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7GTVUmSwyZU
Name ESTRA-1,3,5(10)-TRIENE-7.ALPHA.-METHYL-3,17.BETA.-DIOL
Alternate Name(s) 7-METHYLESTRA-1(10),2,4-TRIENE-3,17-DIOL
CAS Registry Number 10448-97-2
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C19H26O2
InChI InChI=1S/C19H26O2/c1-11-9-12-10-13(20)3-4-14(12)15-7-8-19(2)16(18(11)15)5-6-17(19)21/h3-4,10-11,15-18,20-21H,5-9H2,1-2H3
InChIKey DXWWYJWUFULMAP-UHFFFAOYSA-N
Nominal Mass 286 u
Owner Database Compilation (C) 2005 Wiley & Sons, Inc.
SMILES C12CCC(O)C1(C)CCC1c3ccc(cc3CC(C)C21)O
SPLASH splash10-000i-1890000000-bd6be951c92415a02fc0
Source File Reference LMCM-75569-927V
Source of Spectrum Copyright (C) Dr. Makin, London Hospital Medical College, UK