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1H-2-Benzopyran-3-one, 7-ethoxy-4-hydroxy-4-methoxycarbonyl-
SpectraBase Compound ID FtnIXRwJMsY
InChI InChI=1S/C13H14O6/c1-3-18-9-4-5-10-8(6-9)7-19-12(15)13(10,16)11(14)17-2/h4-6,16H,3,7H2,1-2H3
InChIKey BOOUKSKJDIGYPA-UHFFFAOYSA-N
Mol Weight 266.25 g/mol
Molecular Formula C13H14O6
Exact Mass 266.079038 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JTDRUrS5E6Y
Name 1H-2-Benzopyran-3-one, 7-ethoxy-4-hydroxy-4-methoxycarbonyl-
Alternate Name(s) 7-Ethoxy-4-hydroxy-3-keto-isochroman-4-carboxylic acid methyl ester 7-Ethoxy-4-hydroxy-3-oxo-3,4-dihydro-1H-2-benzopyran-4-carboxylic acid methyl ester Methyl 7-ethoxy-4-hydroxy-3-oxo-1H-isochromene-4-carboxylate Methyl 7-ethoxy-4-hydroxy-3-oxo-3,4-dihydro-1H-isochromene-4-carboxylate Methyl 7-ethoxy-4-hydroxy-3-oxo-isochromane-4-carboxylate Methyl 7-ethoxy-4-oxidanyl-3-oxidanylidene-1H-isochromene-4-carboxylate
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Formula C13H14O6
InChI InChI=1S/C13H14O6/c1-3-18-9-4-5-10-8(6-9)7-19-12(15)13(10,16)11(14)17-2/h4-6,16H,3,7H2,1-2H3
InChIKey BOOUKSKJDIGYPA-UHFFFAOYSA-N
Molecular Weight 266.249 g/mol
SMILES OC1(c2c(cc(cc2)OCC)COC1=O)C(=O)OC
SPLASH splash10-0a4i-5890000000-24d0bcb9a3bdf6134c42
Wiley ID 1496558