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Propanoic acid, 2-[4-(1-formylethyl)phenyl]-, methyl ester
SpectraBase Compound ID EQUpV6U7uWh
InChI InChI=1S/C13H16O3/c1-9(8-14)11-4-6-12(7-5-11)10(2)13(15)16-3/h4-10H,1-3H3
InChIKey DMGBRQANYPZBBY-UHFFFAOYSA-N
Mol Weight 220.27 g/mol
Molecular Formula C13H16O3
Exact Mass 220.109944 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Leu6UQDcR0o
Name Propanoic acid, 2-[4-(1-formylethyl)phenyl]-, methyl ester
Alternate Name(s) 2-[4-(1-oxopropan-2-yl)phenyl]propanoic acid methyl ester 2-[4-(2-keto-1-methyl-ethyl)phenyl]propionic acid methyl ester Methyl 2-[4-(1-methyl-2-oxo-ethyl)phenyl]propanoate Methyl 2-[4-(1-oxidanylidenepropan-2-yl)phenyl]propanoate Methyl 2-[4-(1-oxopropan-2-yl)phenyl]propanoate
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Formula C13H16O3
InChI InChI=1S/C13H16O3/c1-9(8-14)11-4-6-12(7-5-11)10(2)13(15)16-3/h4-10H,1-3H3
InChIKey DMGBRQANYPZBBY-UHFFFAOYSA-N
Molecular Weight 220.268 g/mol
SMILES CC(C=O)c1ccc(cc1)C(C(=O)OC)C
SPLASH splash10-000x-3900000000-d1e453a96a9b6c696c5a
Wiley ID 1493460