| SpectraBase Spectrum ID |
AWxdSZcdRXR |
| Name |
N-(2-Cyano-4,5-diethoxy-phenyl)-2-(4-methoxyphenyl)ethanamide |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
354.157957192 u |
| Formula |
C20H22N2O4 |
| InChI |
InChI=1S/C20H22N2O4/c1-4-25-18-11-15(13-21)17(12-19(18)26-5-2)22-20(23)10-14-6-8-16(24-3)9-7-14/h6-9,11-12H,4-5,10H2,1-3H3,(H,22,23) |
| InChIKey |
CYMJFXYOKNQWBB-UHFFFAOYSA-N |
| Molecular Weight |
354.406 g/mol |
| SMILES |
C1(=C(C#N)C=C(C(=C1)OCC)OCC)NC(=O)CC1=CC=C(OC)C=C1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.926723 |