EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C14H22O2S |
| Net Charge | 0 |
| Average Mass | 254.395 |
| Monoisotopic Mass | 254.13405 |
| SMILES | Cc1occc1SC(C(=O)CC(C)C)C(C)C |
| InChI | InChI=1S/C14H22O2S/c1-9(2)8-12(15)14(10(3)4)17-13-6-7-16-11(13)5/h6-7,9-10,14H,8H2,1-5H3 |
| InChIKey | PFFLSEMCPNTWOY-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 2,6-Dimethyl-3-[(2-methyl-3-furanyl)thio]-4-heptanone (CHEBI:196234) is a aryl sulfide (CHEBI:35683) |
| IUPAC Name |
|---|
| 2,6-dimethyl-3-(2-methyluran-3-yl)sulanylheptan-4-one |
| Manual Xrefs | Databases |
|---|---|
| HMDB0037154 | HMDB |
| 56003 | ChemSpider |