| SpectraBase Spectrum ID |
GpYUX8zbieJ |
| Name |
bis[4-Acetamido-3-chlorophenyl]sulfone |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
400.005133509 u |
| Formula |
C16H14Cl2N2O4S |
| InChI |
InChI=1S/C16H14Cl2N2O4S/c1-9(21)19-15-5-3-11(7-13(15)17)25(23,24)12-4-6-16(14(18)8-12)20-10(2)22/h3-8H,1-2H3,(H,19,21)(H,20,22) |
| InChIKey |
IJNYMFXZMUVYKP-UHFFFAOYSA-N |
| Molecular Weight |
401.264 g/mol |
| SMILES |
C(=O)(C)NC1=CC=C(S(=O)(=O)C2=CC(=C(NC(=O)C)C=C2)Cl)C=C1Cl |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.966356 |
![bis[4-Acetamido-3-chlorophenyl]sulfone](/api/spectrum/GpYUX8zbieJ/structure.png?h=300&w=458 "bis[4-Acetamido-3-chlorophenyl]sulfone")
