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4'-O-[ALPHA-(3-METHOXY-4-ETHOXYPHENYL)-ALPHA-OXO-BETA-HYDROXYMETHYLETHYL]-DEHYDRO-DIVANILLIN
SpectraBase Compound ID 5tgciDuV5Qa
InChI InChI=1S/C28H28O10/c1-5-37-21-7-6-18(12-22(21)34-2)26(32)25(15-31)38-28-20(9-17(14-30)11-24(28)36-4)19-8-16(13-29)10-23(35-3)27(19)33/h6-14,25,31,33H,5,15H2,1-4H3
InChIKey NJIDMNVCKJGOCV-UHFFFAOYSA-N
Mol Weight 524.52 g/mol
Molecular Formula C28H28O10
Exact Mass 524.168247 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CU3ZfmmW3UR
Name 4'-O-[ALPHA-(3-METHOXY-4-ETHOXYPHENYL)-ALPHA-OXO-BETA-HYDROXYMETHYLETHYL]-DEHYDRO-DIVANILLIN
Compound Number III
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C28H28O10
InChI InChI=1S/C28H28O10/c1-5-37-21-7-6-18(12-22(21)34-2)26(32)25(15-31)38-28-20(9-17(14-30)11-24(28)36-4)19-8-16(13-29)10-23(35-3)27(19)33/h6-14,25,31,33H,5,15H2,1-4H3
InChIKey NJIDMNVCKJGOCV-UHFFFAOYSA-N
Literature Reference Author V.L.ALVES,M.G.DRUMOND,G.M.STEFANI,C.L.CHEN,D.PILO-VELOSO
Literature Reference Citation J.BRAZ.CHEM.SOC.,11,467(2000)
Literature Reference DOI 10.1590/s0103-50532000000500006
Molecular Weight 524.524 g/mol
Solvent DMSO-D6
Source File Reference UWMS5690