| SpectraBase Compound ID | KaNwhmlJSgT |
|---|---|
| InChI | InChI=1S/C12H16S/c1-2-3-4-5-6-7-9-12-10-8-11-13-12/h8,10-11H,2-6H2,1H3 |
| InChIKey | YOUHYDPDOBFDCD-UHFFFAOYSA-N |
| Mol Weight | 192.32 g/mol |
| Molecular Formula | C12H16S |
| Exact Mass | 192.097272 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
Subscribe to view the full spectrum.
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | 8SobwYGuk6t |
|---|---|
| Name | 2-(oct-1-Ynyl)thiophene |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 192.097271689 u |
| Formula | C12H16S |
| InChI | InChI=1S/C12H16S/c1-2-3-4-5-6-7-9-12-10-8-11-13-12/h8,10-11H,2-6H2,1H3 |
| InChIKey | YOUHYDPDOBFDCD-UHFFFAOYSA-N |
| Molecular Weight | 192.320 g/mol |
| SMILES | C1(=CC=CS1)C#CCCCCCC |