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Isonicotinic acid
SpectraBase Compound ID 262PT8P0KWd
InChI InChI=1S/C6H5NO2/c8-6(9)5-1-3-7-4-2-5/h1-4H,(H,8,9)
InChIKey TWBYWOBDOCUKOW-UHFFFAOYSA-N
Mol Weight 123.11 g/mol
Molecular Formula C6H5NO2
Exact Mass 123.032028 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1X7eqxhlyF3
Name 4-Pyridinecarboxylic acid
Alternate Name(s) .alpha.-Picolinic acid .gamma.-Picolinic acid 1,4-Dihydroisonicotinic acid 4-Carboxypyridine 4-Picolinic acid Acide iso-nicotinique gamma-Picolinic acid gamma-Pyridinecarboxylic acid INA Isonicotinic acid p-Pyridinecarboxylic acid Pyridine-4-carboxylic acid Pyridinecarboxylic acid-(4) AI3-19239 EINECS 200-228-2 NSC 1483
CAS Registry Number 55-22-1
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Formula C6H5NO2
InChI InChI=1S/C6H5NO2/c8-6(9)5-1-3-7-4-2-5/h1-4H,(H,8,9)
InChIKey TWBYWOBDOCUKOW-UHFFFAOYSA-N
Molecular Weight 123.111 g/mol
SMILES OC(=O)c1ccncc1
SPLASH splash10-00di-6900000000-080aef7362b08b897db8
Source of Spectrum NP-16-7397-0
Wiley ID 1096321