EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C13H16N2O |
| Net Charge | 0 |
| Average Mass | 216.284 |
| Monoisotopic Mass | 216.12626 |
| SMILES | c1ccc(COCCCc2cncn2)cc1 |
| InChI | InChI=1S/C13H16N2O/c1-2-5-12(6-3-1)10-16-8-4-7-13-9-14-11-15-13/h1-3,5-6,9,11H,4,7-8,10H2,(H,14,15) |
| InChIKey | WNWALBVQAAIULR-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 5-(3-phenylmethoxypropyl)-1H-imidazole (CHEBI:93359) is a benzyl ether (CHEBI:59859) |
| Manual Xrefs | Databases |
|---|---|
| LSM-3732 | LINCS |