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6-[(E)-2-CARBOXYVINYL]-3-(4-HYDROXY-3,5-DIMETHOXYPHENYL)-2,3-DIHYDRO-1,4-BENZODIOXANE-2-CARBOXYLIC-ACID
SpectraBase Compound ID 46CJKke1w1k
InChI InChI=1S/C20H18O9/c1-26-14-8-11(9-15(27-2)17(14)23)18-19(20(24)25)28-12-5-3-10(4-6-16(21)22)7-13(12)29-18/h3-9,18-19,23H,1-2H3,(H,21,22)(H,24,25)/b6-4+
InChIKey TUCYELDSVJJVOT-GQCTYLIASA-N
Mol Weight 402.36 g/mol
Molecular Formula C20H18O9
Exact Mass 402.095082 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2KBUaXe0GS5
Name 6-[(E)-2-CARBOXYVINYL]-3-(4-HYDROXY-3,5-DIMETHOXYPHENYL)-2,3-DIHYDRO-1,4-BENZODIOXANE-2-CARBOXYLIC-ACID
Compound Number 17
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H18O9
InChI InChI=1S/C20H18O9/c1-26-14-8-11(9-15(27-2)17(14)23)18-19(20(24)25)28-12-5-3-10(4-6-16(21)22)7-13(12)29-18/h3-9,18-19,23H,1-2H3,(H,21,22)(H,24,25)/b6-4+
InChIKey TUCYELDSVJJVOT-GQCTYLIASA-N
Literature Reference Author D.ARRIETA-BAEZ,R.E.STARK
Literature Reference Citation PHYTOCHEM.,67,743(2006)
Literature Reference DOI 10.1016/j.phytochem.2006.01.026
Molecular Weight 402.358 g/mol
Sample ID 66151
Solvent CD3OD