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4-Methoxy-estra-1,3,5(10)-trien-17-one

View entire compound with spectra: 2 NMR

4-Methoxy-estra-1,3,5(10)-trien-17-one
SpectraBase Compound ID Glnleu1eRPT
InChI InChI=1S/C19H24O2/c1-19-11-10-13-12-4-3-5-17(21-2)15(12)7-6-14(13)16(19)8-9-18(19)20/h3-5,13-14,16H,6-11H2,1-2H3
InChIKey PZYVKCVSDIVIGE-UHFFFAOYSA-N
Mol Weight 284.4 g/mol
Molecular Formula C19H24O2
Exact Mass 284.17763 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3jDgOJODMJF
Name 4-Methoxy-epi(9)-estra-1,3,5(10)-trien-17-one
CAS Registry Number 83801-72-3
Comments HITACHI R-900 SPECTROMETER
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C19H24O2
InChI InChI=1S/C19H24O2/c1-19-11-10-13-12-4-3-5-17(21-2)15(12)7-6-14(13)16(19)8-9-18(19)20/h3-5,13-14,16H,6-11H2,1-2H3
InChIKey PZYVKCVSDIVIGE-UHFFFAOYSA-N
Instrument Name see comment
Literature Reference Y. Ito, M. Nakatsuka, T. Saegusa, J. Am. Chem. Soc. 104, 7609 (1982).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3