quinaldate

Chemical Formula:

C₁₀H₆NO₂

Molecular Weight:

172.163 Daltons

Monoisotopic Mass:

173.0476784741 Daltons

SMILES:

C([O-])(=O)C1(C=CC2(=CC=CC=C(N=1)2))

InChI:

1S/C10H7NO2/c12-10(13)9-6-5-7-3-1-2-4-8(7)11-9/h1-6H,(H,12,13)/p-1

InChIKey:

LOAUVZALPPNFOQ-UHFFFAOYSA-M

Synonyms

Databases

MetaCyc: QUINALDATE

RefMet: Quinaldic acid

HMDB: HMDB00842

ChemSpider: 2777129

ChEBI: 19775

PubChem (CID): 3538644 7124

KEGG: C06325

NCI: 4882

CAS: 93-10-7

Seed: cpd03766

MetaNetX: MNXM4797