| SpectraBase Spectrum ID |
7LAGBaSkTcA |
| Name |
Acetamide, 2-(4-chloro-3,5-dimethylphenoxy)-N-(4-cyanomethylphenyl)- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
328.097855493 u |
| Formula |
C18H17ClN2O2 |
| InChI |
InChI=1S/C18H17ClN2O2/c1-12-9-16(10-13(2)18(12)19)23-11-17(22)21-15-5-3-14(4-6-15)7-8-20/h3-6,9-10H,7,11H2,1-2H3,(H,21,22) |
| InChIKey |
GORVHKPGJNUYQW-UHFFFAOYSA-N |
| Molecular Weight |
328.799 g/mol |
| SMILES |
C1(=C(C=C(C=C1C)OCC(NC1=CC=C(CC#N)C=C1)=O)C)Cl |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.949784 |
