SpectraBase Spectrum ID |
C6X79jhlSNi |
Name |
Acetamide, N-(2-cyano-4,5-diethoxyphenyl)-2-(2-methoxyphenyl)- |
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/c1-4-25-18-10-15(13-21)16(12-19(18)26-5-2)22-20(23)11-14-8-6-7-9-17(14)24-3/h6-10,12H,4-5,11H2,1-3H3,(H,22,23) |
InChIKey |
IKFOGRBJJQRHRN-UHFFFAOYSA-N |
Molecular Weight |
354.406 g/mol |
SMILES |
C1(=C(C#N)C=C(C(=C1)OCC)OCC)NC(CC1=CC=CC=C1OC)=O |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.926453 |