EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C12H10 |
| Net Charge | 0 |
| Average Mass | 154.212 |
| Monoisotopic Mass | 154.07825 |
| SMILES | CC#CC#CCc1ccccc1 |
| InChI | InChI=1S/C12H10/c1-2-3-4-6-9-12-10-7-5-8-11-12/h5,7-8,10-11H,9H2,1H3 |
| InChIKey | WXQYRBLGGSLJHA-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| Capillene (CHEBI:80802) is a benzenes (CHEBI:22712) |
| Manual Xrefs | Databases |
|---|---|
| C16927 | KEGG COMPOUND |
| HMDB0034968 | HMDB |
| Registry Numbers | Sources |
|---|---|
| CAS:520-74-1 | KEGG COMPOUND |