| SpectraBase Spectrum ID |
8sAVYJF13Bw |
| Name |
4'-(Benzylamino)-2',6'-dichloro-2-(diethylamino)acetanilide, monohydrochloride |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
415.098495504 u |
| Formula |
C19H24Cl3N3O |
| InChI |
InChI=1S/C19H23Cl2N3O.ClH/c1-3-24(4-2)13-18(25)23-19-16(20)10-15(11-17(19)21)22-12-14-8-6-5-7-9-14;/h5-11,22H,3-4,12-13H2,1-2H3,(H,23,25);1H |
| InChIKey |
WDEMVNQBMWPIIK-UHFFFAOYSA-N |
| Molecular Weight |
416.780 g/mol |
| SMILES |
N(C1=CC(=C(C(=C1)Cl)NC(CN(CC)CC)=O)Cl)CC=1C=CC=CC1.Cl |
| Spectrum/Structure Validation Score (Raman) |
0.953693 |
