SpectraBase Spectrum ID |
BxRrJdb6dEu |
Name |
Acetamide, N-(2-iodo-4-methylphenyl)-2-phenylthio- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
382.984080248 u |
Formula |
C15H14INOS |
InChI |
InChI=1S/C15H14INOS/c1-11-7-8-14(13(16)9-11)17-15(18)10-19-12-5-3-2-4-6-12/h2-9H,10H2,1H3,(H,17,18) |
InChIKey |
MNHFJTCEGYXIOL-UHFFFAOYSA-N |
Molecular Weight |
383.247 g/mol |
SMILES |
C1=C(C=CC=C1)SCC(NC=1C=CC(C)=CC1I)=O |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.957326 |