| SpectraBase Spectrum ID |
4XdD74F12Ee |
| Name |
N,N'-Diphenyl-p-phenylenediamine, N,N'-bis(heptafluorobutyryl)- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
652.083171979 u |
| Formula |
C26H14F14N2O2 |
| InChI |
InChI=1S/C26H14F14N2O2/c27-21(28,23(31,32)25(35,36)37)19(43)41(15-7-3-1-4-8-15)17-11-13-18(14-12-17)42(16-9-5-2-6-10-16)20(44)22(29,30)24(33,34)26(38,39)40/h1-14H |
| InChIKey |
YTPJLEPGVRPEKY-UHFFFAOYSA-N |
| Molecular Weight |
652.388 g/mol |
| SMILES |
C1(N(C2=CC=CC=C2)C(=O)C(C(C(F)(F)F)(F)F)(F)F)=CC=C(C=C1)N(C1=CC=CC=C1)C(=O)C(C(C(F)(F)F)(F)F)(F)F |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.853758 |
