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2-[1-(4-methoxyphenyl)-5-oxo-4H-pyrazol-3-yl]acetic acid methyl ester
SpectraBase Compound ID Gtdau1CiiAF
InChI InChI=1S/C13H14N2O4/c1-18-11-5-3-10(4-6-11)15-12(16)7-9(14-15)8-13(17)19-2/h3-6H,7-8H2,1-2H3
InChIKey CBUZAPHIURLGAR-UHFFFAOYSA-N
Mol Weight 262.26 g/mol
Molecular Formula C13H14N2O4
Exact Mass 262.095357 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Vgd6uBaHg
Name 2-[1-(4-methoxyphenyl)-5-oxo-4H-pyrazol-3-yl]acetic acid methyl ester
Alternate Name(s) 2-[5-keto-1-(4-methoxyphenyl)-2-pyrazolin-3-yl]acetic acid methyl ester Methyl 2-[1-(4-methoxyphenyl)-5-oxidanylidene-4H-pyrazol-3-yl]ethanoate Methyl 2-[1-(4-methoxyphenyl)-5-oxo-4H-pyrazol-3-yl]acetate [1-(4-Methoxyphenyl)-5-oxo-4,5-dihydro-1H-pyrazol-3-yl]acetic acid, methyl ester
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Formula C13H14N2O4
InChI InChI=1S/C13H14N2O4/c1-18-11-5-3-10(4-6-11)15-12(16)7-9(14-15)8-13(17)19-2/h3-6H,7-8H2,1-2H3
InChIKey CBUZAPHIURLGAR-UHFFFAOYSA-N
Molecular Weight 262.265 g/mol
SMILES COc1ccc(N2N=C(CC(=O)OC)CC2=O)cc1
SPLASH splash10-08g0-9860000000-26037a817ba85d22f01a
Wiley ID 1440943