SpectraBase Spectrum ID |
Leq7sLW8SEC |
Name |
Acetamide, N-(4-bromophenyl)-2-[(phenylmethyl)sulfonyl]- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
366.987777486 u |
Formula |
C15H14BrNO3S |
InChI |
InChI=1S/C15H14BrNO3S/c16-13-6-8-14(9-7-13)17-15(18)11-21(19,20)10-12-4-2-1-3-5-12/h1-9H,10-11H2,(H,17,18) |
InChIKey |
OOYKHZHUPYJVIW-UHFFFAOYSA-N |
Molecular Weight |
368.245 g/mol |
SMILES |
C1=CC(=CC=C1NC(CS(CC=1C=CC=CC1)(=O)=O)=O)Br |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.889752 |