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5-(phenylcarbonyl)pyridazine-3-carboxylic acid
SpectraBase Compound ID 8C4c0YARxEu
InChI InChI=1S/C12H8N2O3/c15-11(8-4-2-1-3-5-8)9-6-10(12(16)17)14-13-7-9/h1-7H,(H,16,17)
InChIKey ZMFXBUXYODZKAG-UHFFFAOYSA-N
Mol Weight 228.21 g/mol
Molecular Formula C12H8N2O3
Exact Mass 228.053492 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6JMVVxXo3br
Name 5-(phenylcarbonyl)pyridazine-3-carboxylic acid
CAS Registry Number 106584-55-8
Comments Less than 3 mono-isotopic peaks
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Formula C12H8N2O3
InChI InChI=1S/C12H8N2O3/c15-11(8-4-2-1-3-5-8)9-6-10(12(16)17)14-13-7-9/h1-7H,(H,16,17)
InChIKey ZMFXBUXYODZKAG-UHFFFAOYSA-N
Molecular Weight 228.207 g/mol
SMILES OC(c1cc(C(=O)c2ccccc2)cnn1)=O
SPLASH splash10-0a4i-0900000000-4850996902067b0afe94
Source of Spectrum Y-22-1546-6
Synonyms 5-Benzoyl-3-pyridazinecarboxylic acid 5-benzoylpyridazine-3-carboxylic acid
Wiley ID 1229437