EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C12H22O2 |
| Net Charge | 0 |
| Average Mass | 198.306 |
| Monoisotopic Mass | 198.16198 |
| SMILES | CCCCCCCCCC(=O)CC=O |
| InChI | InChI=1S/C12H22O2/c1-2-3-4-5-6-7-8-9-12(14)10-11-13/h11H,2-10H2,1H3 |
| InChIKey | QBDCOUHKEVYWLO-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| Decanoyl acetaldehyde (CHEBI:80815) is a saturated fatty aldehyde (CHEBI:133249) |
| Manual Xrefs | Databases |
|---|---|
| C16947 | KEGG COMPOUND |
| Registry Numbers | Sources |
|---|---|
| CAS:56505-80-7 | KEGG COMPOUND |