EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C12H14O4 |
| Net Charge | 0 |
| Average Mass | 222.240 |
| Monoisotopic Mass | 222.08921 |
| SMILES | CC(=O)Oc1ccc(C(C)OC(C)=O)cc1 |
| InChI | InChI=1S/C12H14O4/c1-8(15-9(2)13)11-4-6-12(7-5-11)16-10(3)14/h4-8H,1-3H3 |
| InChIKey | NGFQCVNXZSQSRY-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| Hydroxyphenylethanol diacetate (CHEBI:86656) is a benzoate ester (CHEBI:36054) |
| Hydroxyphenylethanol diacetate (CHEBI:86656) is a phenols (CHEBI:33853) |