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CHEBI:169345 - 2-Acetyl-3,6-dimethylpyrazine

ChEBI IDCHEBI:169345
ChEBI Name2-Acetyl-3,6-dimethylpyrazine
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC8H10N2O
Net Charge0
Average Mass150.181
Monoisotopic Mass150.07931
SMILESCC(=O)c1nc(C)cnc1C
InChIInChI=1S/C8H10N2O/c1-5-4-9-6(2)8(10-5)7(3)11/h4H,1-3H3
InChIKeyJFUVDGXTDCVGHA-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Malus domestica (ncbitaxon:3750) exocarp (BTO:0000733) MetaboLights (MTBLS2384) Strain: Malus x domestica Borkh. cv. Ruixue
ChEBI Ontology
Outgoing Relation(s)
2-Acetyl-3,6-dimethylpyrazine (CHEBI:169345) is a aromatic ketone (CHEBI:76224)
IUPAC Name 
1-(3,6-dimethylpyrazin-2-yl)ethanone
Manual XrefsDatabases
94541ChemSpider
HMDB0039998HMDB
Registry NumbersSources
CAS:54300-09-3ChemIDplus