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CHEBI:180304 - 4-Methylheptane-3,5-dione

ChEBI IDCHEBI:180304
ChEBI Name4-Methylheptane-3,5-dione
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC8H14O2
Net Charge0
Average Mass142.198
Monoisotopic Mass142.09938
SMILESCCC(=O)C(C)C(=O)CC
InChIInChI=1S/C8H14O2/c1-4-7(9)6(3)8(10)5-2/h6H,4-5H2,1-3H3
InChIKeyFIJLPSJMPXGRJL-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
4-Methylheptane-3,5-dione (CHEBI:180304) is a β-diketone (CHEBI:67265)
IUPAC Name 
4-methylheptane-3,5-dione
Manual XrefsDatabases
LMFA12000241LIPID MAPS
2282525ChemSpider
Registry NumbersSources
CAS:1187-04-8ChemIDplus