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Benzoic acid, 2,4-dimethoxy-6-methyl-, 4-carboxy-3-methoxy-5-methylphenyl ester
SpectraBase Compound ID JdfnER6Ep9q
InChI InChI=1S/C19H20O7/c1-10-7-13(9-14(24-4)16(10)18(20)21)26-19(22)17-11(2)6-12(23-3)8-15(17)25-5/h6-9H,1-5H3,(H,20,21)
InChIKey DQQXVSVJAJUHOB-UHFFFAOYSA-N
Mol Weight 360.36 g/mol
Molecular Formula C19H20O7
Exact Mass 360.120903 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID A33LRl6G6C
Name Benzoic acid, 2,4-dimethoxy-6-methyl-, 4-carboxy-3-methoxy-5-methylphenyl ester
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 360.120902977 u
Formula C19H20O7
InChI InChI=1S/C19H20O7/c1-10-7-13(9-14(24-4)16(10)18(20)21)26-19(22)17-11(2)6-12(23-3)8-15(17)25-5/h6-9H,1-5H3,(H,20,21)
InChIKey DQQXVSVJAJUHOB-UHFFFAOYSA-N
Molecular Weight 360.362 g/mol
SMILES C1=C(C=C(C(=C1OC)C(OC1=CC(=C(C(=C1)OC)C(O)=O)C)=O)C)OC