| SpectraBase Spectrum ID |
1BLFOpRaIdy |
| Name |
2,2-Dimethyl-N-(2,2,2-trichloro-1-o-tolylamino-ethyl)-propionamide |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
336.056296339 u |
| Formula |
C14H19Cl3N2O |
| InChI |
InChI=1S/C14H19Cl3N2O/c1-9-7-5-6-8-10(9)18-11(14(15,16)17)19-12(20)13(2,3)4/h5-8,11,18H,1-4H3,(H,19,20) |
| InChIKey |
NPXBZBKADVFZIU-UHFFFAOYSA-N |
| Molecular Weight |
337.678 g/mol |
| SMILES |
C1(NC(NC(C(C)(C)C)=O)C(Cl)(Cl)Cl)=C(C=CC=C1)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.930362 |
