| SpectraBase Compound ID | GVzC9LouUsJ |
|---|---|
| InChI | InChI=1S/C11H13NS/c1-2-3-8-13-11-6-4-10(9-12)5-7-11/h4-7H,2-3,8H2,1H3 |
| InChIKey | FFWRBESWIAGQMC-UHFFFAOYSA-N |
| Mol Weight | 191.29 g/mol |
| Molecular Formula | C11H13NS |
| Exact Mass | 191.076871 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | HK1RLE5za6s |
|---|---|
| Name | 4-(Butylthio)benzonitrile |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C11H13NS |
| InChI | InChI=1S/C11H13NS/c1-2-3-8-13-11-6-4-10(9-12)5-7-11/h4-7H,2-3,8H2,1H3 |
| InChIKey | FFWRBESWIAGQMC-UHFFFAOYSA-N |
| Literature Reference DOI | 10.1021/acs.orglett.6b00208 |
| Molecular Weight | 191.292 g/mol |
| SMILES | C(c1ccc(cc1)SCCCC)#N |
| SPLASH | splash10-000f-1900000000-873bd2487443c17c26c8 |
| Source of Spectrum | A1-18-876/SM16-3a |
| Wiley ID | 1805243 |