| SpectraBase Spectrum ID |
KLqIEKiLab7 |
| Name |
5,5'-[2,2,2-Trifluoro-1-(trifluoromethyl)ethylidene]di-o-toluidine |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
362.121767501 u |
| Formula |
C17H16F6N2 |
| InChI |
InChI=1S/C17H16F6N2/c1-9-3-5-11(7-13(9)24)15(16(18,19)20,17(21,22)23)12-6-4-10(2)14(25)8-12/h3-8H,24-25H2,1-2H3 |
| InChIKey |
HJSYPLCSZPEDCQ-UHFFFAOYSA-N |
| Molecular Weight |
362.319 g/mol |
| SMILES |
NC1=C(C=CC(C(C=2C=C(C(=CC2)C)N)(C(F)(F)F)C(F)(F)F)=C1)C |
| Spectrum/Structure Validation Score (Raman) |
0.836625 |
![5,5'-[2,2,2-Trifluoro-1-(trifluoromethyl)ethylidene]di-o-toluidine](/api/spectrum/KLqIEKiLab7/structure.png?h=300&w=458 "5,5'-[2,2,2-Trifluoro-1-(trifluoromethyl)ethylidene]di-o-toluidine")
