EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C9H12N2O |
| Net Charge | 0 |
| Average Mass | 164.208 |
| Monoisotopic Mass | 164.09496 |
| SMILES | N#CC(C(N)=O)=C1CCCCC1 |
| InChI | InChI=1S/C9H12N2O/c10-6-8(9(11)12)7-4-2-1-3-5-7/h1-5H2,(H2,11,12) |
| InChIKey | HPLVMKGWFQBJOV-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 2-cyano-2-cyclohexylideneacetamide (CHEBI:116997) is a primary carboxamide (CHEBI:140324) |
| Manual Xrefs | Databases |
|---|---|
| LSM-28445 | LINCS |