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(9S,11R)-VINYLCATECHIN-DIMER;ISOMER-1

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(9S,11R)-VINYLCATECHIN-DIMER;ISOMER-1
SpectraBase Compound ID Kv6AIQ7UsiU
InChI InChI=1S/C34H32O12/c1-13-6-27(30-24(41)11-20(37)16-9-25(42)32(46-34(16)30)15-3-5-19(36)23(40)8-15)44-28-12-21(38)17-10-26(43)31(45-33(17)29(13)28)14-2-4-18(35)22(39)7-14/h2-5,7-8,11-13,25-27,31-32,35-43H,6,9-10H2,1H3/t13-,25-,26-,27+,31+,32+/m0/s1
InChIKey FXJBFBFATYRIFZ-VCYTZZLNSA-N
Mol Weight 632.6 g/mol
Molecular Formula C34H32O12
Exact Mass 632.189376 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9To5e85XIJg
Name (9S,11R)-VINYLCATECHIN-DIMER;ISOMER-1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C34H32O12
InChI InChI=1S/C34H32O12/c1-13-6-27(30-24(41)11-20(37)16-9-25(42)32(46-34(16)30)15-3-5-19(36)23(40)8-15)44-28-12-21(38)17-10-26(43)31(45-33(17)29(13)28)14-2-4-18(35)22(39)7-14/h2-5,7-8,11-13,25-27,31-32,35-43H,6,9-10H2,1H3/t13-,25-,26-,27+,31+,32+/m0/s1
InChIKey FXJBFBFATYRIFZ-VCYTZZLNSA-N
Literature Reference Author L.CRUZ,N.F.BRAS,N.TEIXEIRA,A.FERNANDES,N.MATEUS,M.J.RAMOS,J. RODRIGUEZ-BORGES,V.D
Literature Reference Citation J.AGR.FOOD.CHEM.,57,10341(2009)
Literature Reference DOI 10.1021/jf901608n
Molecular Weight 632.621 g/mol
Sample ID 68225
Solvent CD3OD:TFA