| SpectraBase Compound ID | GubsbzCTtkZ |
|---|---|
| InChI | InChI=1S/C16H16O2S/c1-3-12-8-10-13(11-9-12)19-15-7-5-4-6-14(15)16(17)18-2/h4-11H,3H2,1-2H3 |
| InChIKey | CQLTYBKUIGOYKR-UHFFFAOYSA-N |
| Mol Weight | 272.36 g/mol |
| Molecular Formula | C16H16O2S |
| Exact Mass | 272.087101 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 3BMupuDiEq |
|---|---|
| Name | Methyl 2-(4-ethyl-phenylsulfanyl)-benzoate |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C16H16O2S |
| InChI | InChI=1S/C16H16O2S/c1-3-12-8-10-13(11-9-12)19-15-7-5-4-6-14(15)16(17)18-2/h4-11H,3H2,1-2H3 |
| InChIKey | CQLTYBKUIGOYKR-UHFFFAOYSA-N |
| Molecular Weight | 272.362 g/mol |
| SMILES | c1(c(Sc2ccc(cc2)CC)cccc1)C(=O)OC |
| SPLASH | splash10-00fr-0390000000-b95a8468e74d86c5be38 |
| Source of Spectrum | F-65-8799-5k |
| Wiley ID | 1679246 |