EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C7H12O |
| Net Charge | 0 |
| Average Mass | 112.172 |
| Monoisotopic Mass | 112.08882 |
| SMILES | CC1=CCCC(O)C1 |
| InChI | InChI=1S/C7H12O/c1-6-3-2-4-7(8)5-6/h3,7-8H,2,4-5H2,1H3 |
| InChIKey | HKVFKEJBSWJQMU-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| xi-3-Methyl-3-cyclohexen-1-ol (CHEBI:195653) is a secondary alcohol (CHEBI:35681) |
| IUPAC Name |
|---|
| 3-methylcyclohex-3-en-1-ol |
| Manual Xrefs | Databases |
|---|---|
| 492278 | ChemSpider |
| HMDB0034372 | HMDB |