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CHEBI:173579 - 5-Oxo-2(5H)-isoxazolepropanenitrile

ChEBI IDCHEBI:173579
ChEBI Name5-Oxo-2(5H)-isoxazolepropanenitrile
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC6H6N2O2
Net Charge0
Average Mass138.126
Monoisotopic Mass138.04293
SMILESN#CCCn1ccc(=O)o1
InChIInChI=1S/C6H6N2O2/c7-3-1-4-8-5-2-6(9)10-8/h2,5H,1,4H2
InChIKeyDNSSEQBYSHSUGR-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
5-Oxo-2(5H)-isoxazolepropanenitrile (CHEBI:173579) is a isoxazoles (CHEBI:55373)
IUPAC Name 
3-(5-oxo-1,2-oxazol-2-yl)propanenitrile
Manual XrefsDatabases
HMDB0031338HMDB
149543ChemSpider
Registry NumbersSources
CAS:51580-99-5ChemIDplus