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1H-Pyrazole-3-acetic acid, 1-(1H-1,3-benzimidazol-2-yl)-4,5-dihydro-5-oxo-, methyl ester
SpectraBase Compound ID HueS01RVRHG
InChI InChI=1S/C13H12N4O3/c1-20-12(19)7-8-6-11(18)17(16-8)13-14-9-4-2-3-5-10(9)15-13/h2-5H,6-7H2,1H3,(H,14,15)
InChIKey HSYSHRYYIQSMNT-UHFFFAOYSA-N
Mol Weight 272.26 g/mol
Molecular Formula C13H12N4O3
Exact Mass 272.09094 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DM2yWg8X4i5
Name 1H-Pyrazole-3-acetic acid, 1-(1H-1,3-benzimidazol-2-yl)-4,5-dihydro-5-oxo-, methyl ester
Alternate Name(s) 2-[1-(1H-benzimidazol-2-yl)-5-keto-2-pyrazolin-3-yl]acetic acid methyl ester 2-[1-(1H-benzimidazol-2-yl)-5-oxo-4H-pyrazol-3-yl]acetic acid methyl ester Methyl 2-[1-(1H-benzimidazol-2-yl)-5-oxidanylidene-4H-pyrazol-3-yl]ethanoate Methyl 2-[1-(1H-benzimidazol-2-yl)-5-oxo-4H-pyrazol-3-yl]acetate [1-(1H-Benzoimidazol-2-yl)-5-hydroxy-1H-pyrazol-3-yl]acetic acid, methyl ester
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Formula C13H12N4O3
InChI InChI=1S/C13H12N4O3/c1-20-12(19)7-8-6-11(18)17(16-8)13-14-9-4-2-3-5-10(9)15-13/h2-5H,6-7H2,1H3,(H,14,15)
InChIKey HSYSHRYYIQSMNT-UHFFFAOYSA-N
Molecular Weight 272.264 g/mol
SMILES [nH]1c2ccccc2nc1N1N=C(CC(=O)OC)CC1=O
SPLASH splash10-00xr-9880000000-51727bd598aa2530f6f7
Wiley ID 1449562