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6-Hydroxy-1,3-diketo-4-methyl-phthalan-5-carboxylic acid ethyl ester
SpectraBase Compound ID CzmMe0P4X39
InChI InChI=1S/C12H10O6/c1-3-17-11(15)9-5(2)8-6(4-7(9)13)10(14)18-12(8)16/h4,13H,3H2,1-2H3
InChIKey GTXIUEAQFVYCLV-UHFFFAOYSA-N
Mol Weight 250.21 g/mol
Molecular Formula C12H10O6
Exact Mass 250.047738 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID L8iCoykUJN
Name 6-Hydroxy-1,3-diketo-4-methyl-phthalan-5-carboxylic acid ethyl ester
Alternate Name(s) 6-Hydroxy-4-methyl-1,3-dioxo-5-isobenzofurancarboxylic acid ethyl ester Ethyl 4-methyl-6-oxidanyl-1,3-bis(oxidanylidene)-2-benzofuran-5-carboxylate Ethyl 6-hydroxy-4-methyl-1,3-dioxo-2-benzofuran-5-carboxylate Ethyl 6-hydroxy-4-methyl-1,3-dioxo-isobenzofuran-5-carboxylate
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Formula C12H10O6
InChI InChI=1S/C12H10O6/c1-3-17-11(15)9-5(2)8-6(4-7(9)13)10(14)18-12(8)16/h4,13H,3H2,1-2H3
InChIKey GTXIUEAQFVYCLV-UHFFFAOYSA-N
Molecular Weight 250.206 g/mol
SMILES Oc1c(c(c2c(c1)C(OC2=O)=O)C)C(=O)OCC
SPLASH splash10-0w29-1890000000-27e53fad3b65d34c5321
Source of Spectrum KC-0-3640-3
Wiley ID 823981