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EPIGALLOCATECHIN-3-O-(3'-O-METHYL)-GALLATE

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EPIGALLOCATECHIN-3-O-(3'-O-METHYL)-GALLATE
SpectraBase Compound ID Aw6NZT2wqNL
InChI InChI=1S/C23H20O11/c1-32-18-5-10(4-16(28)21(18)30)23(31)34-19-8-12-13(25)6-11(24)7-17(12)33-22(19)9-2-14(26)20(29)15(27)3-9/h2-7,19,22,24-30H,8H2,1H3/t19-,22-/m1/s1
InChIKey WVRDOLPMKOCJRJ-DENIHFKCSA-N
Mol Weight 472.4 g/mol
Molecular Formula C23H20O11
Exact Mass 472.100561 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3DUFIdWnRez
Name EPIGALLOCATECHIN-3-O-(3'-O-METHYL)-GALLATE
Compound Number 10
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C23H20O11
InChI InChI=1S/C23H20O11/c1-32-18-5-10(4-16(28)21(18)30)23(31)34-19-8-12-13(25)6-11(24)7-17(12)33-22(19)9-2-14(26)20(29)15(27)3-9/h2-7,19,22,24-30H,8H2,1H3/t19-,22-/m1/s1
InChIKey WVRDOLPMKOCJRJ-DENIHFKCSA-N
Literature Reference Author A.L.DAVIS,Y.CAI,A.P.DAVIES,J.R.LEWIS
Literature Reference Citation MAGN.RES.CHEM.,34,887(1996)
Literature Reference DOI 10.1002/(sici)1097-458x(199611)34:11<887::aid-omr995>3.0.co;2-u
Molecular Weight 472.405 g/mol
Solvent ACETONE-D6
Source File Reference UWCP430