| SpectraBase Spectrum ID |
DdXKk6fnIF2 |
| Name |
N-[4-(Cyanomethyl)phenyl]-2-(3,5-dimethylphenoxy)ethanamide |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
294.136827826 u |
| Formula |
C18H18N2O2 |
| InChI |
InChI=1S/C18H18N2O2/c1-13-9-14(2)11-17(10-13)22-12-18(21)20-16-5-3-15(4-6-16)7-8-19/h3-6,9-11H,7,12H2,1-2H3,(H,20,21) |
| InChIKey |
CPOABUIOHJNJFA-UHFFFAOYSA-N |
| Molecular Weight |
294.354 g/mol |
| SMILES |
CC=1C=C(OCC(NC2=CC=C(CC#N)C=C2)=O)C=C(C)C1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.860856 |
![N-[4-(cyanomethyl)phenyl]-2-(3,5-dimethylphenoxy)ethanamide](/api/spectrum/DdXKk6fnIF2/structure.png?h=300&w=458 "N-[4-(cyanomethyl)phenyl]-2-(3,5-dimethylphenoxy)ethanamide")
