| SpectraBase Spectrum ID |
1EVRcRpFjn6 |
| Name |
N-Benzoyl-3,3-bis(3'-trifluoromethylphenyl)prop-2-en-1-ylamine |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
449.121433148 u |
| Formula |
C24H17F6NO |
| InChI |
InChI=1S/C24H17F6NO/c25-23(26,27)19-10-4-8-17(14-19)21(18-9-5-11-20(15-18)24(28,29)30)12-13-31-22(32)16-6-2-1-3-7-16/h1-12,14-15H,13H2,(H,31,32) |
| InChIKey |
ZTAUONGNTCWHGX-UHFFFAOYSA-N |
| Molecular Weight |
449.396 g/mol |
| SMILES |
C(C1=CC(C(C=2C=C(C(F)(F)F)C=CC2)=CCNC(=O)C2=CC=CC=C2)=CC=C1)(F)(F)F |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.925514 |
