| SpectraBase Compound ID | J46Y5UkxvXk |
|---|---|
| InChI | InChI=1S/C16H34O2S/c1-3-5-7-9-11-13-15-19(17,18)16-14-12-10-8-6-4-2/h3-16H2,1-2H3 |
| InChIKey | TZPCGEVFZZYCIY-UHFFFAOYSA-N |
| Mol Weight | 290.5 g/mol |
| Molecular Formula | C16H34O2S |
| Exact Mass | 290.227952 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | KrIvOAV9HpK |
|---|---|
| Name | di-N-Octyl-sulfon |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 290.227951507 u |
| Formula | C16H34O2S |
| InChI | InChI=1S/C16H34O2S/c1-3-5-7-9-11-13-15-19(17,18)16-14-12-10-8-6-4-2/h3-16H2,1-2H3 |
| InChIKey | TZPCGEVFZZYCIY-UHFFFAOYSA-N |
| SMILES | C(S(=O)(=O)CCCCCCCC)CCCCCCC |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.937493 |