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4',6,7-Triacetoxy-isoflavone
SpectraBase Compound ID 7o7XuJ7YeV5
InChI InChI=1S/C21H16O8/c1-11(22)27-15-6-4-14(5-7-15)17-10-26-18-9-20(29-13(3)24)19(28-12(2)23)8-16(18)21(17)25/h4-10H,1-3H3
InChIKey XRHUFAPVOZZSDG-UHFFFAOYSA-N
Mol Weight 396.35 g/mol
Molecular Formula C21H16O8
Exact Mass 396.084517 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7laKi3LMjQB
Name 4',6,7-Triacetoxy-isoflavone
CAS Registry Number 20816-28-8
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C21H16O8
InChI InChI=1S/C21H16O8/c1-11(22)27-15-6-4-14(5-7-15)17-10-26-18-9-20(29-13(3)24)19(28-12(2)23)8-16(18)21(17)25/h4-10H,1-3H3
InChIKey XRHUFAPVOZZSDG-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