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ESTR-1-ENE-4.ALPHA.,5.ALPHA.-EPOXY-17.BETA.-OL-3-ONE
SpectraBase Compound ID JuKH3dF6j4L
InChI InChI=1S/C18H24O3/c1-17-8-6-11-10(12(17)3-5-15(17)20)7-9-18-13(11)2-4-14(19)16(18)21-18/h2,4,10-13,15-16,20H,3,5-9H2,1H3
InChIKey OVRPQVINUMQNMU-UHFFFAOYSA-N
Mol Weight 288.39 g/mol
Molecular Formula C18H24O3
Exact Mass 288.172545 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KONcVgI9Z8z
Name ESTR-1-ENE-4.ALPHA.,5.ALPHA.-EPOXY-17.BETA.-OL-3-ONE
Alternate Name(s) 7-HYDROXY-6A-METHYL-4A,4B,5,6,6A,7,8,9,9A,9B,10,11-DODECAHYDROCYCLOPENTA[7,8]PHENANTHRO[1,10A-B]OXIREN-2(1AH)-ONE
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C18H24O3
InChI InChI=1S/C18H24O3/c1-17-8-6-11-10(12(17)3-5-15(17)20)7-9-18-13(11)2-4-14(19)16(18)21-18/h2,4,10-13,15-16,20H,3,5-9H2,1H3
InChIKey OVRPQVINUMQNMU-UHFFFAOYSA-N
Nominal Mass 288 u
Owner Database Compilation (C) 2005 Wiley & Sons, Inc.
SMILES C123CCC4C(CCC5(C)C(CCC45)O)C1C=CC(=O)C3O2
SPLASH splash10-000i-0290000000-aaa67ce9b26c1b2b36cc
Source File Reference LMCM-82002-507T
Source of Spectrum Copyright (C) Dr. Makin, London Hospital Medical College, UK