EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C8H14O4 |
| Net Charge | 0 |
| Average Mass | 174.196 |
| Monoisotopic Mass | 174.08921 |
| SMILES | [H]OC(=O)C([H])([H])C([H])(C([H])([H])C(=O)O[H])C([H])([H])C([H])([H])C([H])([H])[H] |
| InChI | InChI=1S/C8H14O4/c1-2-3-6(4-7(9)10)5-8(11)12/h6H,2-5H2,1H3,(H,9,10)(H,11,12) |
| InChIKey | YHJZYPZZBZPIPX-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 3-PROPYLPENTANEDIOIC ACID (CHEBI:46608) is a unclassifieds (CHEBI:27189) |