EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C10H6N2O |
| Net Charge | 0 |
| Average Mass | 170.171 |
| Monoisotopic Mass | 170.04801 |
| SMILES | N#CC(C#N)=Cc1ccc(O)cc1 |
| InChI | InChI=1S/C10H6N2O/c11-6-9(7-12)5-8-1-3-10(13)4-2-8/h1-5,13H |
| InChIKey | FNCOVSWSZZVFBQ-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 2-[(4-hydroxyphenyl)methylidene]propanedinitrile (CHEBI:107642) is a phenols (CHEBI:33853) |
| Manual Xrefs | Databases |
|---|---|
| LSM-19004 | LINCS |