| SpectraBase Spectrum ID |
WmhlBJV5nT |
| Name |
Hexadecyl p-tolyl sulfone |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
380.274901700 u |
| Formula |
C23H40O2S |
| InChI |
InChI=1S/C23H40O2S/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-21-26(24,25)23-19-17-22(2)18-20-23/h17-20H,3-16,21H2,1-2H3 |
| InChIKey |
DOKRNCKMWMCPKZ-UHFFFAOYSA-N |
| Molecular Weight |
380.631 g/mol |
| SMILES |
C=1C(=CC=C(C1)C)S(=O)(=O)CCCCCCCCCCCCCCCC |
| Spectrum/Structure Validation Score (Raman) |
0.9466 |
