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6-Hydroxy-3-(3-methoxycarbonyl-propionyl)-2-methyl-benzoic acid, methyl ester
SpectraBase Compound ID 4qnAxjTdfiV
InChI InChI=1S/C14H16O6/c1-8-9(10(15)6-7-12(17)19-2)4-5-11(16)13(8)14(18)20-3/h4-5,16H,6-7H2,1-3H3
InChIKey ZOLDIQAGPLDFLG-UHFFFAOYSA-N
Mol Weight 280.28 g/mol
Molecular Formula C14H16O6
Exact Mass 280.094688 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HzonuXqg8Es
Name 6-Hydroxy-3-(3-methoxycarbonyl-propionyl)-2-methyl-benzoic acid, methyl ester
CAS Registry Number 56704-60-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H16O6
InChI InChI=1S/C14H16O6/c1-8-9(10(15)6-7-12(17)19-2)4-5-11(16)13(8)14(18)20-3/h4-5,16H,6-7H2,1-3H3
InChIKey ZOLDIQAGPLDFLG-UHFFFAOYSA-N
Molecular Weight 280.276 g/mol
SMILES Oc1ccc(c(c1C(=O)OC)C)C(=O)CCC(=O)OC
SPLASH splash10-03dl-2910000000-6abb04e183dd153d0400
Synonyms 6-Hydroxy-3-(4-keto-4-methoxy-butanoyl)-2-methyl-benzoic acid methyl ester 6-Hydroxy-3-(4-methoxy-1,4-dioxobutyl)-2-methylbenzoic acid methyl ester Methyl 3-(4-methoxy-4-oxidanylidene-butanoyl)-2-methyl-6-oxidanyl-benzoate Methyl 6-hydroxy-3-(4-methoxy-4-oxo-butanoyl)-2-methyl-benzoate
Wiley ID 1481530