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CHEBI:195719 - 3,4,4-Trimethyl-1,2-cyclopentanedione

ChEBI IDCHEBI:195719
ChEBI Name3,4,4-Trimethyl-1,2-cyclopentanedione
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC8H12O2
Net Charge0
Average Mass140.182
Monoisotopic Mass140.08373
SMILESCC1=C(O)C(=O)CC1(C)C
InChIInChI=1S/C8H12O2/c1-5-7(10)6(9)4-8(5,2)3/h10H,4H2,1-3H3
InChIKeyLTRJTLUJZFBIEN-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
3,4,4-Trimethyl-1,2-cyclopentanedione (CHEBI:195719) is a cyclic ketone (CHEBI:3992)
IUPAC Name 
2-hydroxy-3,4,4-trimethylcyclopent-2-en-1-one
Manual XrefsDatabases
HMDB0040526HMDB
4934163ChemSpider