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1H-Pyrazole-5-carboxylic acid, 3-[[(4-fluorophenyl)amino]carbonyl]-1-methyl-, methyl ester
SpectraBase Compound ID IDVN0CEgA5B
InChI InChI=1S/C13H12FN3O3/c1-17-11(13(19)20-2)7-10(16-17)12(18)15-9-5-3-8(14)4-6-9/h3-7H,1-2H3,(H,15,18)
InChIKey WLPJAXJBRPFBJM-UHFFFAOYSA-N
Mol Weight 277.26 g/mol
Molecular Formula C13H12FN3O3
Exact Mass 277.086269 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DFI7GTgMZdl
Name 1H-Pyrazole-5-carboxylic acid, 3-[[(4-fluorophenyl)amino]carbonyl]-1-methyl-, methyl ester
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Formula C13H12FN3O3
InChI InChI=1S/C13H12FN3O3/c1-17-11(13(19)20-2)7-10(16-17)12(18)15-9-5-3-8(14)4-6-9/h3-7H,1-2H3,(H,15,18)
InChIKey WLPJAXJBRPFBJM-UHFFFAOYSA-N
Molecular Weight 277.255 g/mol
SMILES N(C(c1cc([n](n1)C)C(=O)OC)=O)c1ccc(F)cc1
SPLASH splash10-014i-7920000000-1748635bafa63f084d37
Source of Spectrum IY-2-4760-7
Synonyms Methyl 3-[(4-fluorophenyl)carbamoyl]-1-methyl-1H-pyrazole-5-carboxylate 5-[(4-fluoroanilino)-oxomethyl]-2-methyl-3-pyrazolecarboxylic acid methyl ester Methyl 5-[(4-fluorophenyl)carbamoyl]-2-methylpyrazole-3-carboxylate Methyl 5-[(4-fluorophenyl)carbamoyl]-2-methyl-pyrazole-3-carboxylate
Wiley ID 1655590