| SpectraBase Compound ID | 8se2mvhvlYd |
|---|---|
| InChI | InChI=1S/C20H42S/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20(2)21-3/h20H,4-19H2,1-3H3 |
| InChIKey | UHLPOTVTNGIELW-UHFFFAOYSA-N |
| Mol Weight | 314.6 g/mol |
| Molecular Formula | C20H42S |
| Exact Mass | 314.300723 g/mol |
Vapor Phase (Gas) Infrared Spectrum
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | 5t2frQylqE3 |
|---|---|
| Name | 2-Methylthiononadecane |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 314.300722526 u |
| Formula | C20H42S |
| InChI | InChI=1S/C20H42S/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20(2)21-3/h20H,4-19H2,1-3H3 |
| InChIKey | UHLPOTVTNGIELW-UHFFFAOYSA-N |
| Molecular Weight | 314.616 g/mol |
| SMILES | C(CCCCCCCCCCCCCCC)CC(SC)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.946979 |