| SpectraBase Spectrum ID |
5pCy2qA8MTE |
| Name |
Benzamide, 3,4-dimethoxy-N-(2-cyanophenyl)- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
282.100442316 u |
| Formula |
C16H14N2O3 |
| InChI |
InChI=1S/C16H14N2O3/c1-20-14-8-7-11(9-15(14)21-2)16(19)18-13-6-4-3-5-12(13)10-17/h3-9H,1-2H3,(H,18,19) |
| InChIKey |
OOYBYKPTJHVBQK-UHFFFAOYSA-N |
| Molecular Weight |
282.299 g/mol |
| SMILES |
C(NC1=CC=CC=C1C#N)(C1=CC(OC)=C(C=C1)OC)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.934595 |
