SpectraBase Spectrum ID |
55xgkqCQLrm |
Name |
2-(Benzhydrylamino)acetonitrile |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
222.115698459 u |
Formula |
C15H14N2 |
InChI |
InChI=1S/C15H14N2/c16-11-12-17-15(13-7-3-1-4-8-13)14-9-5-2-6-10-14/h1-10,15,17H,12H2 |
InChIKey |
SGGWZHLJPPJPTP-UHFFFAOYSA-N |
Molecular Weight |
222.291 g/mol |
SMILES |
C(CNC(C=1C=CC=CC1)C=1C=CC=CC1)#N |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.98439 |