![Ethyl 3-[(Methylthio)methyl]benzoate](/api/spectrum/C4u9XBfkOQt/structure.png?h=300&w=458 "Ethyl 3-[(Methylthio)methyl]benzoate")
| SpectraBase Compound ID | IEp7SfZOYAk |
|---|---|
| InChI | InChI=1S/C11H14O2S/c1-3-13-11(12)10-6-4-5-9(7-10)8-14-2/h4-7H,3,8H2,1-2H3 |
| InChIKey | MGJUPGTUCUMFNF-UHFFFAOYSA-N |
| Mol Weight | 210.29 g/mol |
| Molecular Formula | C11H14O2S |
| Exact Mass | 210.071451 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | C4u9XBfkOQt |
|---|---|
| Name | Ethyl 3-[(Methylthio)methyl]benzoate |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C11H14O2S |
| InChI | InChI=1S/C11H14O2S/c1-3-13-11(12)10-6-4-5-9(7-10)8-14-2/h4-7H,3,8H2,1-2H3 |
| InChIKey | MGJUPGTUCUMFNF-UHFFFAOYSA-N |
| Molecular Weight | 210.291 g/mol |
| SMILES | C(c1cc(CSC)ccc1)(=O)OCC |
| SPLASH | splash10-03di-0910000000-76856f24095db840731a |
| Source of Spectrum | F4-42-888-3l |
| Wiley ID | 1673694 |