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CHEBI:151053 - 2,4-Dimethyl-2,4-dihydro-3H-pyrazol-3-one

ChEBI IDCHEBI:151053
ChEBI Name2,4-Dimethyl-2,4-dihydro-3H-pyrazol-3-one
Stars
Submittermwilliams
DownloadsMolfile
FormulaC5H8N2O
Net Charge0
Average Mass112.132
Monoisotopic Mass112.06366
SMILESC[C@H]1C=NN(C)C1=O
InChIInChI=1S/C5H8N2O/c1-4-3-6-7(2)5(4)8/h3-4H,1-2H3/t4-/m0/s1
InChIKeyMXOJCJMABJVNNA-BYPYZUCNSA-N
Species of MetaboliteComponentSourceComments
Escherichia coli (ncbitaxon:562) cell lysate (BTO:0004304) MetaboLights (MTBLS1079) Strain: Escherichia coli str. K-12 substr. DH10B [NCBITAXON:316385]
ChEBI Ontology
Outgoing Relation(s)
2,4-Dimethyl-2,4-dihydro-3H-pyrazol-3-one (CHEBI:151053) is a pyrazoles (CHEBI:26410)
IUPAC Name 
2,4-dimethyl-4H-pyrazol-3-one