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6,7-Diphenylmethylenedioxy-4'-hydroxy-isoflavone
SpectraBase Compound ID AFGMkWDe3dC
InChI InChI=1S/C28H18O5/c29-21-13-11-18(12-14-21)23-17-31-24-16-26-25(15-22(24)27(23)30)32-28(33-26,19-7-3-1-4-8-19)20-9-5-2-6-10-20/h1-17,29H
InChIKey NQXCDQCQFURPKD-UHFFFAOYSA-N
Mol Weight 434.45 g/mol
Molecular Formula C28H18O5
Exact Mass 434.115424 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8bNI2Y62cLD
Name 6,7-Diphenylmethylenedioxy-4'-hydroxy-isoflavone
CAS Registry Number 75187-61-0
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C28H18O5
InChI InChI=1S/C28H18O5/c29-21-13-11-18(12-14-21)23-17-31-24-16-26-25(15-22(24)27(23)30)32-28(33-26,19-7-3-1-4-8-19)20-9-5-2-6-10-20/h1-17,29H
InChIKey NQXCDQCQFURPKD-UHFFFAOYSA-N
Instrument Name Bruker WP-60
Literature Reference H. Jha, F. Zilliken, Can. J. Chem. 58, 1211 (1980).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3/DMSO-D6