| SpectraBase Compound ID | HQvEtZaMuDY |
|---|---|
| InChI | InChI=1S/C13H20OS/c1-3-4-5-6-11-15-13-9-7-12(14-2)8-10-13/h7-10H,3-6,11H2,1-2H3 |
| InChIKey | RIEYWUMDZQPODX-UHFFFAOYSA-N |
| Mol Weight | 224.36 g/mol |
| Molecular Formula | C13H20OS |
| Exact Mass | 224.123486 g/mol |
Vapor Phase (Gas) Infrared Spectrum
Subscribe to view the full spectrum.
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | 60HfwJDusnv |
|---|---|
| Name | Hexyl 4-methoxyphenyl sulfide |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 224.123486437 u |
| Formula | C13H20OS |
| InChI | InChI=1S/C13H20OS/c1-3-4-5-6-11-15-13-9-7-12(14-2)8-10-13/h7-10H,3-6,11H2,1-2H3 |
| InChIKey | RIEYWUMDZQPODX-UHFFFAOYSA-N |
| Molecular Weight | 224.362 g/mol |
| SMILES | C=1C(=CC=C(C1)OC)SCCCCCC |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.87186 |