John Wiley & Sons, Inc. SpectraBase; SpectraBase Compound ID=4SFg7Otu3wL SpectraBase Spectrum ID=5QjAZM438zB

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Gallocatechin-(4a,2)-phloroglucinol
SpectraBase Compound ID 4SFg7Otu3wL
InChI InChI=1S/C21H18O10/c22-8-3-10(24)16(11(25)4-8)18-17-12(26)5-9(23)6-15(17)31-21(20(18)30)7-1-13(27)19(29)14(28)2-7/h1-6,18,20-30H
InChIKey FNEBVYZAXMQESG-UHFFFAOYSA-N
Mol Weight 430.37 g/mol
Molecular Formula C21H18O10
Exact Mass 430.089997 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5QjAZM438zB
Name Gallocatechin-(4a,2)-phloroglucinol
CAS Registry Number 141605-04-1
Comments ACETONE-D6/WATER 1/1 AS SOLVENT
Copyright Copyright © 2002-2021 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C21H18O10
InChI InChI=1S/C21H18O10/c22-8-3-10(24)16(11(25)4-8)18-17-12(26)5-9(23)6-15(17)31-21(20(18)30)7-1-13(27)19(29)14(28)2-7/h1-6,18,20-30H
InChIKey FNEBVYZAXMQESG-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
SpectraBase Batch ID Cj4dLNwdICI