| 2D Structure | |
| CID | 5352711 |
| Target | / |
| IUPAC Name | (E)-4-(2,6,6-trimethylcyclohexa-1,3-dien-1-yl)but-3-en-2-one |
| InChI | InChI=1S/C13H18O/c1-10-6-5-9-13(3,4)12(10)8-7-11(2)14/h5-8H,9H2,1-4H3/b8-7+ |
| InChI Key | UWWCASOGCPOGJP-BQYQJAHWSA-N |
| Canonical SMILES | CC1=C(C(CC=C1)(C)C)C=CC(=O)C |
| Isomeric SMILES | CC1=C(C(CC=C1)(C)C)/C=C/C(=O)C |
| Molecular Formula | C13H18O |
| Molecular Weight | 190.28 |
| synonyms | ['3-Buten-2-one, 4-(2,6,6-trimethyl-1,3-cyclohexadien-1-yl)-', '1203-08-3', 'Dehydro-beta-ionone', '4-(2,6,6-Trimethylcyclohexa-1,3-dienyl)but-3-en-2-one', '3,4-dehydro-beta-ionone', '(E)-4-(2,6,6-trimethylcyclohexa-1,3-dien-1-yl)but-3-en-2-one', '14398-35-7', '(3E)-4-(2,6,6-Trimethyl-1,3-cyclohexadien-1-yl)-3-buten-2-one', 'beta-Ionone, dehydro-', 'Dehydro-.beta.-ionone', '3,4-Dehydro-.beta.-ionone', '3QF34T7DB3', 'SCHEMBL4202838', '4-(2,6,6-TRIMETHYLCYCLOHEXA-1,3-DIEN-1-YL)BUT-3-EN-2-ONE', '4-(2,6,6-Trimethyl-1,3-cyclohexadienyl)but-3-en-2-one', 'DTXSID60880769', 'CHEBI:168826', 'NS00095825', '4-(2,6,6-Trimethyl-1,3-cyclohexadien-1-yl)-3-buten-2-one #', '4-(2,6,6-TRIMETHYL-1,3-CYCLOHEXADIEN-1-YL)-3-BUTEN-2-ONE'] |
From Pubchem