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2,3-Dihydroxyestra-1,3,5(10)trien-17-one
SpectraBase Compound ID J5tFHg4VZKk
InChI InChI=1S/C18H22O3/c1-18-7-6-11-12(14(18)4-5-17(18)21)3-2-10-8-15(19)16(20)9-13(10)11/h8-9,11-12,14,19-20H,2-7H2,1H3
InChIKey SWINWPBPEKHUOD-UHFFFAOYSA-N
Mol Weight 286.37 g/mol
Molecular Formula C18H22O3
Exact Mass 286.156895 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID C6ziqKKLjrO
Name 2,3-Dihydroxy-estra-1,3,5(10)-trien-17-one
CAS Registry Number 362-06-1
Comments VARIAN FT-80 OR BRUKER AM-500 SPECTROMETER
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C18H22O3
InChI InChI=1S/C18H22O3/c1-18-7-6-11-12(14(18)4-5-17(18)21)3-2-10-8-15(19)16(20)9-13(10)11/h8-9,11-12,14,19-20H,2-7H2,1H3
InChIKey SWINWPBPEKHUOD-UHFFFAOYSA-N
Instrument Name see comment
Literature Reference S. Hrycko, P. Morand, J. Chem. Soc. Perkin I 2899 (1990).
NMR Standard CDCl3
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3