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2-(5-keto-2H-furan-4-yl)benzoic acid methyl ester
SpectraBase Compound ID A0qH2dQ2gNP
InChI InChI=1S/C12H10O4/c1-15-11(13)9-5-3-2-4-8(9)10-6-7-16-12(10)14/h2-6H,7H2,1H3
InChIKey LQNOAIQXZMIRMG-UHFFFAOYSA-N
Mol Weight 218.21 g/mol
Molecular Formula C12H10O4
Exact Mass 218.057909 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID E3bnDXY67RL
Name 2-(5-keto-2H-furan-4-yl)benzoic acid methyl ester
Alternate Name(s) 2-(5-oxo-2H-furan-4-yl)benzoic acid methyl ester Methyl 2-(2-oxo-2,5-dihydro-3-furanyl)benzoate Methyl 2-(5-oxidanylidene-2H-furan-4-yl)benzoate Methyl 2-(5-oxo-2H-furan-4-yl)benzoate
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Formula C12H10O4
InChI InChI=1S/C12H10O4/c1-15-11(13)9-5-3-2-4-8(9)10-6-7-16-12(10)14/h2-6H,7H2,1H3
InChIKey LQNOAIQXZMIRMG-UHFFFAOYSA-N
Molecular Weight 218.208 g/mol
SMILES C1(OCC=C1c1c(cccc1)C(=O)OC)=O
SPLASH splash10-000i-0910000000-11843891b1d0f1551af6
Source of Spectrum KC-0-1918-20
Wiley ID 786287