EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C9H8N2O |
| Net Charge | 0 |
| Average Mass | 160.176 |
| Monoisotopic Mass | 160.06366 |
| SMILES | Oc1cnn(-c2ccccc2)c1 |
| InChI | InChI=1S/C9H8N2O/c12-9-6-10-11(7-9)8-4-2-1-3-5-8/h1-7,12H |
| InChIKey | PAIIFXHEHLRVNC-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 1-phenyl-4-pyrazolol (CHEBI:123258) is a pyrazoles (CHEBI:26410) |
| 1-phenyl-4-pyrazolol (CHEBI:123258) is a ring assembly (CHEBI:36820) |
| Manual Xrefs | Databases |
|---|---|
| LSM-34700 | LINCS |