Quinaldic acid

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Systematic / IUPAC Name: 2-Quinolinecarboxylic acid

ID: Reference1390

Other Names: 2-Quinolinylcarboxylate;
Quinolin-2-carboxylate;
Quinolin-2-carboxylic acid;
Quinaldinate

Formula: C10H7NO2

Class: Endogenous Metabolites

Spectral Data

Quinaldic 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 1
No. of Spectra 39
Tandem Spectra MS1, MS2
Ionization Methods ESI
Analyzers FT
Last Modification 12/3/2014 3:18:47 PM
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Identificators

InChI InChI=1S/C10H7NO2/c12-10(13)9-6-5-7-3-1-2-4-8(7)11-9/h1-6H,(H,12,13)
InChI Key LOAUVZALPPNFOQ-UHFFFAOYSA-N
Canonical SMILES C1=CC=C2C(=C1)C=CC(=N2)C(=O)O
CAS 93107
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Other Names 2-Quinolinylcarboxylate;
Quinolin-2-carboxylate;
Quinolin-2-carboxylic acid;
Quinaldinate

In Other Databases

KEGG C06325
ChemSpider 6857
PubChem 7124
ChEMBL CHEMBL1160559
HMDb HMDB00842
ChemIDPlus 000093107
ChEBI CHEBI:18386