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Benzenebutanoic acid, .beta.-(2,4-dimethoxyphenyl)-2,4-dimethoxy-.gamma.-oxo-, methyl ester

View entire compound with spectra: 1 NMR, and 1 MS (GC)

Benzenebutanoic acid, .beta.-(2,4-dimethoxyphenyl)-2,4-dimethoxy-.gamma.-oxo-, methyl ester
SpectraBase Compound ID GCJioySvbFm
InChI InChI=1S/C21H24O7/c1-24-13-6-8-15(18(10-13)26-3)17(12-20(22)28-5)21(23)16-9-7-14(25-2)11-19(16)27-4/h6-11,17H,12H2,1-5H3
InChIKey LOCIACFZNONICY-UHFFFAOYSA-N
Mol Weight 388.42 g/mol
Molecular Formula C21H24O7
Exact Mass 388.152203 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DJxFZFDAiwe
Name Benzenebutanoic acid, .beta.-(2,4-dimethoxyphenyl)-2,4-dimethoxy-.gamma.-oxo-, methyl ester
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 388.152203106 u
Formula C21H24O7
InChI InChI=1S/C21H24O7/c1-24-13-6-8-15(18(10-13)26-3)17(12-20(22)28-5)21(23)16-9-7-14(25-2)11-19(16)27-4/h6-11,17H,12H2,1-5H3
InChIKey LOCIACFZNONICY-UHFFFAOYSA-N
Molecular Weight 388.416 g/mol
SMILES C(C(C=1C(=CC(=CC1)OC)OC)CC(=O)OC)(C=1C(=CC(=CC1)OC)OC)=O