EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C6H12O |
| Net Charge | 0 |
| Average Mass | 100.161 |
| Monoisotopic Mass | 100.08882 |
| SMILES | C=CC(O)CCC |
| InChI | InChI=1S/C6H12O/c1-3-5-6(7)4-2/h4,6-7H,2-3,5H2,1H3 |
| InChIKey | BVOSSZSHBZQJOI-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 1-Hexen-3-ol (CHEBI:173346) is a secondary alcohol (CHEBI:35681) |
| IUPAC Name |
|---|
| hex-1-en-3-ol |
| Manual Xrefs | Databases |
|---|---|
| 19689 | ChemSpider |
| HMDB0031503 | HMDB |
| Registry Numbers | Sources |
|---|---|
| CAS:4798-44-1 | ChemIDplus |