EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C13H8F3N3O |
| Net Charge | 0 |
| Average Mass | 279.221 |
| Monoisotopic Mass | 279.06195 |
| SMILES | FC(F)(F)Oc1ccc(-c2cn3cccnc3n2)cc1 |
| InChI | InChI=1S/C13H8F3N3O/c14-13(15,16)20-10-4-2-9(3-5-10)11-8-19-7-1-6-17-12(19)18-11/h1-8H |
| InChIKey | SZQGKYQVQCHWMB-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 2-[4-(trifluoromethoxy)phenyl]imidazo[1,2-a]pyrimidine (CHEBI:121768) is a imidazoles (CHEBI:24780) |
| Manual Xrefs | Databases |
|---|---|
| LSM-33211 | LINCS |