EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C11H8 |
| Net Charge | 0 |
| Average Mass | 140.185 |
| Monoisotopic Mass | 140.06260 |
| SMILES | C#CC#CCc1ccccc1 |
| InChI | InChI=1S/C11H8/c1-2-3-5-8-11-9-6-4-7-10-11/h1,4,6-7,9-10H,8H2 |
| InChIKey | ZZGANZXITREHOP-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 5-Phenyl-1,3-pentadiyne (CHEBI:81290) is a benzenes (CHEBI:22712) |
| Manual Xrefs | Databases |
|---|---|
| C17717 | KEGG COMPOUND |
| HMDB0032948 | HMDB |