SpectraBase Spectrum ID |
1dcNuWCECx6 |
Name |
5tf-2C-H N,N-bis(2-Chlorobenzyl) |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
483.097968839 u |
Formula |
C24H22Cl2F3NO2 |
InChI |
InChI=1S/C24H22Cl2F3NO2/c1-31-23-11-10-20(32-24(27,28)29)14-17(23)12-13-30(15-18-6-2-4-8-21(18)25)16-19-7-3-5-9-22(19)26/h2-11,14H,12-13,15-16H2,1H3 |
InChIKey |
SPPDYQSIOQTNDT-UHFFFAOYSA-N |
Molecular Weight |
484.346 g/mol |
SMILES |
C1(=C(C=CC(=C1)OC(F)(F)F)OC)CCN(CC=1C(=CC=CC1)Cl)CC=1C(=CC=CC1)Cl |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.802692 |