SpectraBase Spectrum ID |
7A1KT5uj7Yw |
Name |
(2-Benzylsulfanyl-phenyl)-[1-pyridin-2-yl-meth-(E)-ylidene]-amine |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
304.103419697 u |
Formula |
C19H16N2S |
InChI |
InChI=1S/C19H16N2S/c1-2-8-16(9-3-1)15-22-19-12-5-4-11-18(19)21-14-17-10-6-7-13-20-17/h1-14H,15H2/b21-14+ |
InChIKey |
SYJSOSHVRPGJLG-KGENOOAVSA-N |
Molecular Weight |
304.411 g/mol |
SMILES |
C=1(\N=C\C=2N=CC=CC2)C(SCC2=CC=CC=C2)=CC=CC1 |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.960342 |