SpectraBase Spectrum ID |
42ek7DhoMN4 |
Name |
2'-(p-Tolylthio)cinnamanilide |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
345.118735409 u |
Formula |
C22H19NOS |
InChI |
InChI=1S/C22H19NOS/c1-17-11-14-19(15-12-17)25-21-10-6-5-9-20(21)23-22(24)16-13-18-7-3-2-4-8-18/h2-16H,1H3,(H,23,24) |
InChIKey |
QPZKISSQBGOULY-UHFFFAOYSA-N |
Molecular Weight |
345.460 g/mol |
SMILES |
N(C(C=CC1=CC=CC=C1)=O)C=1C(=CC=CC1)SC=1C=CC(=CC1)C |
Spectrum/Structure Validation Score (Raman) |
0.974213 |