| 2D Structure | |
| CID | 10176665 |
| Target | / |
| IUPAC Name | (E)-4-(3-hydroxy-2,6,6-trimethylcyclohexen-1-yl)but-3-en-2-one |
| InChI | InChI=1S/C13H20O2/c1-9(14)5-6-11-10(2)12(15)7-8-13(11,3)4/h5-6,12,15H,7-8H2,1-4H3/b6-5+ |
| InChI Key | LICNQDPDQQOXCU-AATRIKPKSA-N |
| Canonical SMILES | CC1=C(C(CCC1O)(C)C)C=CC(=O)C |
| Isomeric SMILES | CC1=C(C(CCC1O)(C)C)/C=C/C(=O)C |
| Molecular Formula | C13H20O2 |
| Molecular Weight | 208.30 |
| synonyms | ['14398-34-6', '(3E)-4-(3-Hydroxy-2,6,6-trimethyl-1-cyclohexen-1-yl)-3-buten-2-one', '(3E)-4-(3-HYDROXY-2,6,6-TRIMETHYLCYCLOHEX-1-EN-1-YL)BUT-3-EN-2-ONE', '4-Hydroxy-beta-ionone', '3-hydroxy-.beta.-ionone', 'SCHEMBL8011545', 'LICNQDPDQQOXCU-AATRIKPKSA-N', 'NS00113929', '(E)-4-(3-Hydroxy-2,6,6-trimethylcyclohex-1-en-1-yl)but-3-en-2-one'] |
From Pubchem