| 2D Structure | |
| CID | 18645216 |
| Target | |
| IUPAC Name | (4E)-4-[(E)-but-2-enylidene]-3,5,5-trimethylcyclohex-2-en-1-one |
| InChI | InChI=1S/C13H18O/c1-5-6-7-12-10(2)8-11(14)9-13(12,3)4/h5-8H,9H2,1-4H3/b6-5+,12-7- |
| InChI Key | CBQXHTWJSZXYSK-DFTQQVSXSA-N |
| Canonical SMILES | CC=CC=C1C(=CC(=O)CC1(C)C)C |
| Isomeric SMILES | C/C=C/C=C\1/C(=CC(=O)CC1(C)C)C |
| Molecular Formula | C13H18O |
| Molecular Weight | 190.28 |
| synonyms | ['Megastigmatrienone D', 'MEGASTIGMATRIENONE 4', '9XFN7T7VV5', '2-Cyclohexen-1-one, 4-(2-butenylidene)-3,5,5-trimethyl-, (E,E)-', 'DTXSID701045121', 'FEMA NO. 4663, (2E,4E)-', '5164-78-3', 'EINECS 225-943-7', '2-CYCLOHEXEN-1-ONE, 4-(2E)-2-BUTEN-1-YLIDENE-3,5,5-TRIMETHYL-, (4E)-', '2-CYCLOHEXEN-1-ONE, 4-(2E)-2-BUTENYLIDENE-3,5,5-TRIMETHYL-, (4E)-', 'DTXCID90909311', 'Tabanone', '13215-88-8', '3,5,5-Trimethyl-4-butenylidene-2-cyclohexen-1-one', 'Megastigmatrienone (mixed isomers)', '2-Cyclohexen-1-one, 4-(2-buten-1-ylidene)-3,5,5-trimethyl-', 'SCHEMBL756992', '(4E)-4-[(2E)-BUT-2-EN-1-YLIDENE]-3,5,5-TRIMETHYLCYCLOHEX-2-EN-1-ONE', 'MFCD09751414', 'AKOS006327931', 's11013', '(6Z,8E)-4,6,8-megastigmatrien-3-one', 'FT167655', 'HY-133185', 'Q27273350'] |
From Pubchem