| SpectraBase Compound ID | B6Fq14KLv6w |
|---|---|
| InChI | InChI=1S/C10H11NS/c1-2-7-12-10-6-4-3-5-9(10)8-11/h3-6H,2,7H2,1H3 |
| InChIKey | ONQUCCRLLAQDSG-UHFFFAOYSA-N |
| Mol Weight | 177.26 g/mol |
| Molecular Formula | C10H11NS |
| Exact Mass | 177.061221 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 8mjfgKXxwx4 |
|---|---|
| Name | 2-(Propylthio)benzonitrile |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C10H11NS |
| InChI | InChI=1S/C10H11NS/c1-2-7-12-10-6-4-3-5-9(10)8-11/h3-6H,2,7H2,1H3 |
| InChIKey | ONQUCCRLLAQDSG-UHFFFAOYSA-N |
| Literature Reference DOI | 10.1021/acs.orglett.6b00208 |
| Molecular Weight | 177.265 g/mol |
| SMILES | C(c1c(cccc1)SCCC)#N |
| SPLASH | splash10-000i-0900000000-aa9bfc750b68f51ac856 |
| Source of Spectrum | A1-18-876/SM10-2g |
| Wiley ID | 1805234 |