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5-Benzoyl-6-methyl-3-pyridazinecarboxylic acid
SpectraBase Compound ID InNOhklPvTA
InChI InChI=1S/C13H10N2O3/c1-8-10(7-11(13(17)18)15-14-8)12(16)9-5-3-2-4-6-9/h2-7H,1H3,(H,17,18)
InChIKey YTSFYOYEPHFWBC-UHFFFAOYSA-N
Mol Weight 242.23 g/mol
Molecular Formula C13H10N2O3
Exact Mass 242.069142 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BIkKmznXmYj
Name 5-Benzoyl-6-methyl-3-pyridazinecarboxylic acid
CAS Registry Number 106584-56-9
Comments Less than 3 mono-isotopic peaks
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Formula C13H10N2O3
InChI InChI=1S/C13H10N2O3/c1-8-10(7-11(13(17)18)15-14-8)12(16)9-5-3-2-4-6-9/h2-7H,1H3,(H,17,18)
InChIKey YTSFYOYEPHFWBC-UHFFFAOYSA-N
Molecular Weight 242.234 g/mol
SMILES OC(c1cc(C(=O)c2ccccc2)c(nn1)C)=O
SPLASH splash10-0a4i-0920000000-36363c38deb8aee5edf9
Source of Spectrum Y-22-1546-6
Synonyms 5-benzoyl-6-methyl-pyridazine-3-carboxylic acid 6-methyl-5-(phenylcarbonyl)pyridazine-3-carboxylic acid
Wiley ID 1244896