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CHEBI:109055 - 4-(4-methylphenyl)sulfonyl-4-oxanecarboxylic acid methyl ester
| Formula | C14H18O5S |
| Net Charge | 0 |
| Average Mass | 298.360 |
| Monoisotopic Mass | 298.08749 |
| SMILES | COC(=O)C1(S(=O)(=O)c2ccc(C)cc2)CCOCC1 |
| InChI | InChI=1S/C14H18O5S/c1-11-3-5-12(6-4-11)20(16,17)14(13(15)18-2)7-9-19-10-8-14/h3-6H,7-10H2,1-2H3 |
| InChIKey | LMWFDNMZTICDIT-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 4-(4-methylphenyl)sulfonyl-4-oxanecarboxylic acid methyl ester (CHEBI:109055) is a sulfonic acid derivative (CHEBI:33552) |
| Manual Xrefs | Databases |
|---|---|
| LSM-20453 | LINCS |