Quinolinic acid

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Systematic / IUPAC Name: 2,3-Pyridinedicarboxylic acid

ID: Reference1262

Other Names: Pyridine-2,3-dicarboxylic acid;
Pyridine-2,3-carboxylate

Formula: C7H5NO4

Class: Endogenous Metabolites

Spectral Data

Quinolinic acid mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.

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Available MS Data

Used Instruments Orbitrap Elite
No. of Spectral Trees 2
No. of Spectra 400
Tandem Spectra MS1, MS2, MS3, MS4
Ionization Methods ESI
Analyzers FT
Last Modification 12/4/2014 12:54:03 PM
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Identificators

InChI InChI=1S/C7H5NO4/c9-6(10)4-2-1-3-8-5(4)7(11)12/h1-3H,(H,9,10)(H,11,12)
InChI Key GJAWHXHKYYXBSV-UHFFFAOYSA-N
Canonical SMILES C1=CC(=C(N=C1)C(=O)O)C(=O)O
CAS 89009
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Other Names Pyridine-2,3-dicarboxylic acid;
Pyridine-2,3-carboxylate

In Other Databases

HMDb HMDB00232
PubChem 1066
KEGG C03722
ChEMBL CHEMBL286204
ChemSpider 1037
Wikipedia Quinolinic acid
ChEBI CHEBI:16675
ChemIDPlus 000089009; 018970622; 087314996