SpectraBase Spectrum ID |
9Be33S1Twgg |
Name |
4,6-bis(Phenylsulfonyl)-m-xylene |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
386.064651404 u |
Formula |
C20H18O4S2 |
InChI |
InChI=1S/C20H18O4S2/c1-15-13-16(2)20(26(23,24)18-11-7-4-8-12-18)14-19(15)25(21,22)17-9-5-3-6-10-17/h3-14H,1-2H3 |
InChIKey |
UNWWROCAZJJOEG-UHFFFAOYSA-N |
Molecular Weight |
386.480 g/mol |
SMILES |
C1=CC=C(S(C=2C(C)=CC(C)=C(C2)S(=O)(=O)C=2C=CC=CC2)(=O)=O)C=C1 |
Spectrum/Structure Validation Score (Raman) |
0.947434 |