| SpectraBase Spectrum ID |
1Ok0pE9Zdln |
| Name |
4-Chloro-N-(2-(diethylamino)ethyl)benzamide |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
254.118590939 u |
| Formula |
C13H19ClN2O |
| InChI |
InChI=1S/C13H19ClN2O/c1-3-16(4-2)10-9-15-13(17)11-5-7-12(14)8-6-11/h5-8H,3-4,9-10H2,1-2H3,(H,15,17) |
| InChIKey |
SGQXWVJTZCWVBO-UHFFFAOYSA-N |
| Molecular Weight |
254.761 g/mol |
| SMILES |
C(C1=CC=C(C=C1)Cl)(=O)NCCN(CC)CC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.921544 |