EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C13H18FNO4 |
| Net Charge | 0 |
| Average Mass | 271.288 |
| Monoisotopic Mass | 271.12199 |
| SMILES | COc1cc(F)c(C(=O)NC(C)(C)CO)cc1OC |
| InChI | InChI=1S/C13H18FNO4/c1-13(2,7-16)15-12(17)8-5-10(18-3)11(19-4)6-9(8)14/h5-6,16H,7H2,1-4H3,(H,15,17) |
| InChIKey | HSFWXMXVUGUCRM-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 2-fluoro-N-(1-hydroxy-2-methylpropan-2-yl)-4,5-dimethoxybenzamide (CHEBI:92193) is a dimethoxybenzene (CHEBI:51681) |
| Manual Xrefs | Databases |
|---|---|
| LSM-2231 | LINCS |