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4-(5-(2-Hydroxyphenyl)-3-oxo-2,3-dihydropyrazol-1-yl)benzoic acid
SpectraBase Compound ID 4lJCaXMkXtx
InChI InChI=1S/C16H12N2O4/c19-14-4-2-1-3-12(14)13-9-15(20)17-18(13)11-7-5-10(6-8-11)16(21)22/h1-9,19H,(H,17,20)(H,21,22)
InChIKey UCXKDCJZIPGJGA-UHFFFAOYSA-N
Mol Weight 296.28 g/mol
Molecular Formula C16H12N2O4
Exact Mass 296.079707 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LLvk1FHMktQ
Name 4-(5-(2-Hydroxyphenyl)-3-oxo-2,3-dihydropyrazol-1-yl)benzoic acid
Alternate Name(s) 4-[3-(2-hydroxyphenyl)-5-oxo-1H-pyrazol-2-yl]benzoic acid 4-[3-(2-hydroxyphenyl)-5-oxidanylidene-1H-pyrazol-2-yl]benzoic acid
Comments Less than 3 mono-isotopic peaks
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Formula C16H12N2O4
InChI InChI=1S/C16H12N2O4/c19-14-4-2-1-3-12(14)13-9-15(20)17-18(13)11-7-5-10(6-8-11)16(21)22/h1-9,19H,(H,17,20)(H,21,22)
InChIKey UCXKDCJZIPGJGA-UHFFFAOYSA-N
Molecular Weight 296.282 g/mol
SMILES N1C(C=C(N1c1ccc(C(=O)O)cc1)c1c(O)cccc1)=O
SPLASH splash10-0002-0090000000-74e72883aa2d4c00392a
Source of Spectrum F2-44-4631-4c
Wiley ID 1705848