EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C10H12O3 |
| Net Charge | 0 |
| Average Mass | 180.203 |
| Monoisotopic Mass | 180.07864 |
| SMILES | CCC(O)c1ccc2c(c1)OCO2 |
| InChI | InChI=1S/C10H12O3/c1-2-8(11)7-3-4-9-10(5-7)13-6-12-9/h3-5,8,11H,2,6H2,1H3 |
| InChIKey | PXFYAFDHWSXVLU-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 1-(3,4-Methylenedioxyphenyl)-propane-1-ol (CHEBI:167430) is a benzodioxoles (CHEBI:38298) |
| IUPAC Name |
|---|
| 1-(1,3-benzodioxol-5-yl)propan-1-ol |