EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C9H16O3 |
| Net Charge | 0 |
| Average Mass | 172.224 |
| Monoisotopic Mass | 172.10994 |
| SMILES | CCCC(=O)OCC1CCCO1 |
| InChI | InChI=1S/C9H16O3/c1-2-4-9(10)12-7-8-5-3-6-11-8/h8H,2-7H2,1H3 |
| InChIKey | DPZVDLFOAZNCBU-UHFFFAOYSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Malus domestica (ncbitaxon:3750) | exocarp (BTO:0000733) | MetaboLights (MTBLS2384) | Strain: Malus x domestica Borkh. cv. Ruixue |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| Tetrahydrofurfuryl butyrate (CHEBI:168905) is a fatty acid ester (CHEBI:35748) |
| IUPAC Name |
|---|
| oxolan-2-ylmethyl butanoate |
| Manual Xrefs | Databases |
|---|---|
| 479603 | ChemSpider |
| HMDB0036188 | HMDB |
| Registry Numbers | Sources |
|---|---|
| CAS:2217-33-6 | ChemIDplus |