SpectraBase Spectrum ID |
L5TMHKD28i3 |
Name |
Ethanedione, 1-phenyl-2-phenylsulfonyl-, 2-(4-methylphenylhydrazone) |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
378.103813619 u |
Formula |
C21H18N2O3S |
InChI |
InChI=1S/C21H18N2O3S/c1-16-12-14-18(15-13-16)22-23-21(20(24)17-8-4-2-5-9-17)27(25,26)19-10-6-3-7-11-19/h2-15,22H,1H3/b23-21+ |
InChIKey |
ZGMUBHLSEXLCJT-XTQSDGFTSA-N |
Molecular Weight |
378.446 g/mol |
SMILES |
C1=CC=CC(=C1)S(\C(C(C1=CC=CC=C1)=O)=N/NC1=CC=C(C)C=C1)(=O)=O |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.936371 |