EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C8H14O3 |
| Net Charge | 0 |
| Average Mass | 158.197 |
| Monoisotopic Mass | 158.09429 |
| SMILES | CCC1OC2(C)OCCC1O2 |
| InChI | InChI=1S/C8H14O3/c1-3-6-7-4-5-9-8(2,10-6)11-7/h6-7H,3-5H2,1-2H3 |
| InChIKey | CWTQYXSFDFSPQG-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 6-Ethyl-1-methyl-2,7,8-trioxabicyclo[3.2.1]octane (CHEBI:173669) is a oxacycle (CHEBI:38104) |
| IUPAC Name |
|---|
| 6-ethyl-1-methyl-2,7,8-trioxabicyclo[3.2.1]octane |
| Manual Xrefs | Databases |
|---|---|
| HMDB0030303 | HMDB |
| 35013177 | ChemSpider |