| SpectraBase Compound ID | AMMcCelLID1 |
|---|---|
| InChI | InChI=1S/C12H16O2S/c1-5-14-12(13)10-6-8(2)11(15-4)9(3)7-10/h6-7H,5H2,1-4H3 |
| InChIKey | WEWKDUHBBQKMCR-UHFFFAOYSA-N |
| Mol Weight | 224.32 g/mol |
| Molecular Formula | C12H16O2S |
| Exact Mass | 224.087101 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | u662laJjX |
|---|---|
| Name | Ethyl (3,5-dimethyl-4-methylthio)benzoate |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C12H16O2S |
| InChI | InChI=1S/C12H16O2S/c1-5-14-12(13)10-6-8(2)11(15-4)9(3)7-10/h6-7H,5H2,1-4H3 |
| InChIKey | WEWKDUHBBQKMCR-UHFFFAOYSA-N |
| Ionization Type | EI-B |
| Molecular Weight | 224.318 g/mol |
| SMILES | CCOC(=O)c1cc(c(c(c1)C)SC)C |
| SPLASH | splash10-00b9-5940000000-dcba745325a01413de35 |
| Source of Spectrum | SRH-2022-9638-0 |
| Wiley ID | 1831285 |