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3-[(E)-3-keto-3-methoxy-prop-1-enyl]benzoic acid methyl ester
SpectraBase Compound ID C7LPcw2EjVc
InChI InChI=1S/C12H12O4/c1-15-11(13)7-6-9-4-3-5-10(8-9)12(14)16-2/h3-8H,1-2H3/b7-6+
InChIKey XPSVBFWYSAVLGD-VOTSOKGWSA-N
Mol Weight 220.22 g/mol
Molecular Formula C12H12O4
Exact Mass 220.073559 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2HlMrfJ1Kbi
Name 3-[(E)-3-keto-3-methoxy-prop-1-enyl]benzoic acid methyl ester
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Formula C12H12O4
InChI InChI=1S/C12H12O4/c1-15-11(13)7-6-9-4-3-5-10(8-9)12(14)16-2/h3-8H,1-2H3/b7-6+
InChIKey XPSVBFWYSAVLGD-VOTSOKGWSA-N
Molecular Weight 220.224 g/mol
SMILES C(c1cc(\C=C\C(=O)OC)ccc1)(=O)OC
SPLASH splash10-059i-0930000000-3e916f445f643f19367c
Source of Spectrum F-34-1898-0
Synonyms 3-[(E)-3-methoxy-3-oxoprop-1-enyl]benzoic acid methyl ester Methyl 3-[(E)-3-methoxy-3-oxidanylidene-prop-1-enyl]benzoate Methyl 3-[(E)-3-methoxy-3-oxo-prop-1-enyl]benzoate
Wiley ID 1219652