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Methyl 2-hydroxy-3-(4-methoxy-4-oxobutanoyl)-6-methylbenzoate
SpectraBase Compound ID Cz6uXvMRTtD
InChI InChI=1S/C14H16O6/c1-8-4-5-9(10(15)6-7-11(16)19-2)13(17)12(8)14(18)20-3/h4-5,17H,6-7H2,1-3H3
InChIKey OJNXGSDWMMKMPI-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 GuNFYfDbnoK
Name Methyl 2-hydroxy-3-(4-methoxy-4-oxobutanoyl)-6-methylbenzoate
Alternate Name(s) 2-Hydroxy-3-(4-keto-4-methoxy-butanoyl)-6-methyl-benzoic acid methyl ester 2-Hydroxy-3-(4-methoxy-1,4-dioxobutyl)-6-methylbenzoic acid methyl ester Benzenebutanoic acid, 2-hydroxy-3-(methoxycarbonyl)-4-methyl-.gamma.-oxo-, methyl ester Methyl 3-(4-methoxy-4-oxidanylidene-butanoyl)-6-methyl-2-oxidanyl-benzoate
CAS Registry Number 56704-57-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H16O6
InChI InChI=1S/C14H16O6/c1-8-4-5-9(10(15)6-7-11(16)19-2)13(17)12(8)14(18)20-3/h4-5,17H,6-7H2,1-3H3
InChIKey OJNXGSDWMMKMPI-UHFFFAOYSA-N
Molecular Weight 280.276 g/mol
SMILES Oc1c(ccc(c1C(=O)OC)C)C(=O)CCC(=O)OC
SPLASH splash10-03di-2920000000-f260b91ce51424a5d732
Wiley ID 1481523