EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C8H16O2 |
| Net Charge | 0 |
| Average Mass | 144.214 |
| Monoisotopic Mass | 144.11503 |
| SMILES | CCOC(=O)CC(C)CC |
| InChI | InChI=1S/C8H16O2/c1-4-7(3)6-8(9)10-5-2/h7H,4-6H2,1-3H3 |
| InChIKey | TXAWGHYFBQBVNK-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| Ethyl 3-methylpentanoate (CHEBI:179931) is a fatty acid ester (CHEBI:35748) |
| IUPAC Name |
|---|
| ethyl 3-methylpentanoate |
| Manual Xrefs | Databases |
|---|---|
| 487029 | ChemSpider |
| HMDB0034234 | HMDB |
| LMFA07010864 | LIPID MAPS |
| Registry Numbers | Sources |
|---|---|
| CAS:5870-68-8 | ChemIDplus |