| SpectraBase Spectrum ID |
53m9dxokoUL |
| Name |
(E)-2-Benzoyl-3-(naphthalen-2-yl)acrylonitrile |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
283.099714042 u |
| Formula |
C20H13NO |
| InChI |
InChI=1S/C20H13NO/c21-14-19(20(22)17-7-2-1-3-8-17)13-15-10-11-16-6-4-5-9-18(16)12-15/h1-13H/b19-13+ |
| InChIKey |
TZCBIHHGIIGHTO-CPNJWEJPSA-N |
| SMILES |
C(\C(=C/C1=CC2=C(C=CC=C2)C=C1)C(C1=CC=CC=C1)=O)#N |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.952015 |
