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Malonic acid (3',5'-Dimethoxybenzoin) ester Methyl ester
SpectraBase Compound ID 8CaHqq7qS4I
InChI InChI=1S/C20H20O7/c1-24-15-9-14(10-16(11-15)25-2)20(27-18(22)12-17(21)26-3)19(23)13-7-5-4-6-8-13/h4-11,20H,12H2,1-3H3
InChIKey IPKYXVIKOTVOBJ-UHFFFAOYSA-N
Mol Weight 372.37 g/mol
Molecular Formula C20H20O7
Exact Mass 372.120903 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID C3iwo2YGVXr
Name Malonic acid (3',5'-Dimethoxybenzoin) ester Methyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H20O7
InChI InChI=1S/C20H20O7/c1-24-15-9-14(10-16(11-15)25-2)20(27-18(22)12-17(21)26-3)19(23)13-7-5-4-6-8-13/h4-11,20H,12H2,1-3H3
InChIKey IPKYXVIKOTVOBJ-UHFFFAOYSA-N
Molecular Weight 372.373 g/mol
SMILES C(c1cc(OC)cc(c1)OC)(C(=O)c1ccccc1)OC(CC(=O)OC)=O
SPLASH splash10-0a4i-9810000000-1b960b3806d4c38ab0b5
Source of Spectrum J-67-5576-18
Synonyms 1-[1-(3,5-dimethoxyphenyl)-2-oxo-2-phenylethyl]3-methyl malonate 3-O-[1-(3,5-dimethoxyphenyl)-2-oxo-2-phenylethyl]1-O-methyl propanedioate malonic acid O3-[1-(3,5-dimethoxyphenyl)-2-keto-2-phenyl-ethyl]ester O1-methyl ester O3-[1-(3,5-dimethoxyphenyl)-2-oxidanylidene-2-phenyl-ethyl]O1-methyl propanedioate O3-[1-(3,5-dimethoxyphenyl)-2-oxo-2-phenyl-ethyl]O1-methyl propanedioate Propanedioic acid O3-[1-(3,5-dimethoxyphenyl)-2-oxo-2-phenylethyl]ester O1-methyl ester Propanedioic acid O3-[1-(3,5-dimethoxyphenyl)-2-oxo-2-phenylethyl] ester O1-methyl ester 3-O-[1-(3,5-dimethoxyphenyl)-2-oxo-2-phenylethyl] 1-O-methyl propanedioate O3-[1-(3,5-dimethoxyphenyl)-2-oxo-2-phenyl-ethyl] O1-methyl propanedioate O3-[1-(3,5-dimethoxyphenyl)-2-oxidanylidene-2-phenyl-ethyl] O1-methyl propanedioate
Wiley ID 1570551