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CHEBI:171692 - Octyl phenylacetate
| Formula | C16H24O2 |
| Net Charge | 0 |
| Average Mass | 248.366 |
| Monoisotopic Mass | 248.17763 |
| SMILES | CCCCCCCCOC(=O)Cc1ccccc1 |
| InChI | InChI=1S/C16H24O2/c1-2-3-4-5-6-10-13-18-16(17)14-15-11-8-7-9-12-15/h7-9,11-12H,2-6,10,13-14H2,1H3 |
| InChIKey | VGYPAVUJUMQTGE-UHFFFAOYSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Homo sapiens (ncbitaxon:9606) | |||
| blood plasma (BTO:0000131) | MetaboLights (MTBLS2128) | ||
| Pooled sample (NCIT:C45910) | MetaboLights (MTBLS2128) |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| Octyl phenylacetate (CHEBI:171692) is a carboxylic ester (CHEBI:33308) |
| IUPAC Name |
|---|
| octyl 2-phenylacetate |
| Manual Xrefs | Databases |
|---|---|
| 55009 | ChemSpider |
| HMDB0037713 | HMDB |
| LMFA07010982 | LIPID MAPS |
| Registry Numbers | Sources |
|---|---|
| CAS:122-45-2 | ChemIDplus |