| SpectraBase Compound ID | CvjUreJnMge |
|---|---|
| InChI | InChI=1S/C13H16S/c1-11-5-7-12(8-6-11)9-10-14-13(2,3)4/h5-8H,1-4H3 |
| InChIKey | CAAYKYBBPAJNHX-UHFFFAOYSA-N |
| Mol Weight | 204.33 g/mol |
| Molecular Formula | C13H16S |
| Exact Mass | 204.097272 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | AKy5mrN5Dkk |
|---|---|
| Name | Tert-Butyl(p-tolylethynyl)sulfane |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C13H16S |
| InChI | InChI=1S/C13H16S/c1-11-5-7-12(8-6-11)9-10-14-13(2,3)4/h5-8H,1-4H3 |
| InChIKey | CAAYKYBBPAJNHX-UHFFFAOYSA-N |
| Literature Reference DOI | 10.1021/jo500814y |
| Molecular Weight | 204.331 g/mol |
| SMILES | c1cc(C#CSC(C)(C)C)ccc1C |
| SPLASH | splash10-000t-9710000000-1052b08df3b37a1486f9 |
| Source of Spectrum | J-79-5873-4h |
| Wiley ID | 1746300 |