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(4R)-5,10-Seco-estra-4,5-diene-3,10,17-trione

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(4R)-5,10-Seco-estra-4,5-diene-3,10,17-trione
SpectraBase Compound ID IW6APzWrykH
InChI InChI=1S/C18H22O3/c1-18-11-10-14-13(15(18)7-9-17(18)21)5-3-2-4-12(19)6-8-16(14)20/h3-4,13-15H,5-11H2,1H3
InChIKey TVSJVIZRKSYPGW-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 ArW8rPVYeu7
Name (4R)-5,10-Seco-estra-4,5-diene-3,10,17-trione
CAS Registry Number 60398-18-7
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C18H22O3
InChI InChI=1S/C18H22O3/c1-18-11-10-14-13(15(18)7-9-17(18)21)5-3-2-4-12(19)6-8-16(14)20/h3-4,13-15H,5-11H2,1H3
InChIKey TVSJVIZRKSYPGW-UHFFFAOYSA-N
Instrument Name Jeol FX-60
Literature Reference R.J. Mighet, D.F. Covey, C.H. Robinson, J. Org. Chem. 45, 3286 (1980).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CD2Cl2