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16,17-Bis(acetyloxy)estra-1,3,5(10)-trien-3-yl acetate
SpectraBase Compound ID ABxoHE2JN0G
InChI InChI=1S/C24H30O6/c1-13(25)28-17-6-8-18-16(11-17)5-7-20-19(18)9-10-24(4)21(20)12-22(29-14(2)26)23(24)30-15(3)27/h6,8,11,19-23H,5,7,9-10,12H2,1-4H3
InChIKey DKZPDNPWKHTWCC-UHFFFAOYSA-N
Mol Weight 414.5 g/mol
Molecular Formula C24H30O6
Exact Mass 414.204239 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KaM5wGLPkip
Name ESTRA-1,3,5(10)-TRIENE-3,16.BETA.,17.ALPHA.-TRIOL(3,16.BETA.,17.ALPHA.-TRI-ACETATE)
Alternate Name(s) 16,17-BIS(ACETYLOXY)ESTRA-1(10),2,4-TRIEN-3-YL ACETATE
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C24H30O6
InChI InChI=1S/C24H30O6/c1-13(25)28-17-6-8-18-16(11-17)5-7-20-19(18)9-10-24(4)21(20)12-22(29-14(2)26)23(24)30-15(3)27/h6,8,11,19-23H,5,7,9-10,12H2,1-4H3
InChIKey DKZPDNPWKHTWCC-UHFFFAOYSA-N
Nominal Mass 414 u
Owner Database Compilation (C) 2005 Wiley & Sons, Inc.
SMILES C12(C)CCC3C(CCc4cc(OC(C)=O)ccc34)C2CC(OC(C)=O)C1OC(C)=O
SPLASH splash10-00di-1975000000-d4815752ed02a9b594fa
Source File Reference LMCM-57786-357R
Source of Spectrum Copyright (C) Dr. Makin, London Hospital Medical College, UK