SpectraBase Spectrum ID |
CiOvd0VN2wc |
Name |
bis[4-Acetamidophenyl]sulfoxide |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
316.088163554 u |
Formula |
C16H16N2O3S |
InChI |
InChI=1S/C16H16N2O3S/c1-11(19)17-13-3-7-15(8-4-13)22(21)16-9-5-14(6-10-16)18-12(2)20/h3-10H,1-2H3,(H,17,19)(H,18,20) |
InChIKey |
HABWONZJSRPOIE-UHFFFAOYSA-N |
Molecular Weight |
316.375 g/mol |
SMILES |
C1(S(=O)C2=CC=C(NC(=O)C)C=C2)=CC=C(NC(=O)C)C=C1 |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.90187 |