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4-(3-Methyl-1,4-dioxo-1,4-dihydro-naphthalene-2-carbonyl)-benzoic acid methyl ester
SpectraBase Compound ID y02dCxgUnQ
InChI InChI=1S/C20H14O5/c1-11-16(19(23)15-6-4-3-5-14(15)17(11)21)18(22)12-7-9-13(10-8-12)20(24)25-2/h3-10H,1-2H3
InChIKey ORDAHSIOSQODTM-UHFFFAOYSA-N
Mol Weight 334.33 g/mol
Molecular Formula C20H14O5
Exact Mass 334.084124 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID wtuIUtbW1i
Name 4-(3-Methyl-1,4-dioxo-1,4-dihydro-naphthalene-2-carbonyl)-benzoic acid methyl ester
Appearance Yellow solid
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Formula C20H14O5
InChI InChI=1S/C20H14O5/c1-11-16(19(23)15-6-4-3-5-14(15)17(11)21)18(22)12-7-9-13(10-8-12)20(24)25-2/h3-10H,1-2H3
InChIKey ORDAHSIOSQODTM-UHFFFAOYSA-N
Ionization Type EI
Molecular Weight 334.327 g/mol
SMILES c1cc2c(C(C(=C(C2=O)C)C(c2ccc(cc2)C(=O)OC)=O)=O)cc1
SPLASH splash10-03gi-0976000000-1d1342072fcc86d2ca83
Source of Spectrum US20110059972A1
Wiley ID 1861687