EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C14H20O2 |
| Net Charge | 0 |
| Average Mass | 220.312 |
| Monoisotopic Mass | 220.14633 |
| SMILES | CC(C)(C)c1ccc([C@@H](O)CCC=O)cc1 |
| InChI | InChI=1S/C14H20O2/c1-14(2,3)12-8-6-11(7-9-12)13(16)5-4-10-15/h6-10,13,16H,4-5H2,1-3H3/t13-/m0/s1 |
| InChIKey | ZYVUKLLYGNROKO-ZDUSSCGKSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 4-(4-tert-butylphenyl)-4-hydroxybutanal (CHEBI:143489) is a alkylbenzene (CHEBI:38976) |