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Epicatechin-(4b,2)-phloroglucinol
SpectraBase Compound ID 7gAEpQOXWIg
InChI InChI=1S/C21H18O9/c22-9-4-13(26)17(14(27)5-9)19-18-15(28)6-10(23)7-16(18)30-21(20(19)29)8-1-2-11(24)12(25)3-8/h1-7,19-29H
InChIKey OKJJBTUOKCQSPH-UHFFFAOYSA-N
Mol Weight 414.37 g/mol
Molecular Formula C21H18O9
Exact Mass 414.095082 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID E2lq0D6n7fr
Name Epicatechin-(4b,2)-phloroglucinol
CAS Registry Number 141605-03-0
Comments ACETONE-D6/WATER 1/1 AS SOLVENT
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C21H18O9
InChI InChI=1S/C21H18O9/c22-9-4-13(26)17(14(27)5-9)19-18-15(28)6-10(23)7-16(18)30-21(20(19)29)8-1-2-11(24)12(25)3-8/h1-7,19-29H
InChIKey OKJJBTUOKCQSPH-UHFFFAOYSA-N
Instrument Name Bruker WM-250
Literature Reference R.H. Newman, L.J. Porter, L.Y.Foo, Magn. Res. Chem. 25, 118 (1987).
NMR Standard not reported
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent Mixture