Substance
  • Substance Name: alpha-ionone
  • Formula: C13H20O
  • Molecular Weight: 192.30 g/mol
  • Identifiers:
    • inchi: InChI=1S/C13H20O/c1-10-6-5-9-13(3,4)12(10)8-7-11(2)14/h6-8,12H,5,9H2,1-4H3/b8-7+
    • inchikey: UZFLPKAIBPNNCA-BQYQJAHWSA-N
    • casrn: 127-41-3
    • csmiles: CC1=CCCC(C1C=CC(=O)C)(C)C
    • ismiles: CC1=CCCC(C1/C=C/C(=O)C)(C)C
    • pubchemId: 5282108
    • iupacname: (E)-4-(2,6,6-trimethylcyclohex-2-en-1-yl)but-3-en-2-one
    • wikidataId: Q27114869
    • chemspiderId: 4445317
    • dsstoxcmpId: DTXCID8015160
    • chemblId: CHEMBL472877
    • ecnumber: 204-841-6
alpha-ionone
Systems and Datasets