EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C8H14O |
| Net Charge | 0 |
| Average Mass | 126.199 |
| Monoisotopic Mass | 126.10447 |
| SMILES | CC=CC(=O)CC(C)C |
| InChI | InChI=1S/C8H14O/c1-4-5-8(9)6-7(2)3/h4-5,7H,6H2,1-3H3 |
| InChIKey | VJQKJGLHKJYTQM-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 6-Methyl-2-hepten-4-one (CHEBI:167405) is a enone (CHEBI:51689) |
| IUPAC Name |
|---|
| 6-methylhept-2-en-4-one |
| Manual Xrefs | Databases |
|---|---|
| 57562301 | ChemSpider |