| SpectraBase Spectrum ID |
KiM3IUrP8kI |
| Name |
1,3-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 |
500.020571721 u |
| Formula |
C14H6F14N2O2 |
| InChI |
InChI=1S/C14H6F14N2O2/c15-9(16,11(19,20)13(23,24)25)7(31)29-5-2-1-3-6(4-5)30-8(32)10(17,18)12(21,22)14(26,27)28/h1-4H,(H,29,31)(H,30,32) |
| InChIKey |
DXAPKYLFBXPQRX-UHFFFAOYSA-N |
| Molecular Weight |
500.192 g/mol |
| SMILES |
C1(=CC(=CC=C1)NC(=O)C(C(C(F)(F)F)(F)F)(F)F)NC(=O)C(C(C(F)(F)F)(F)F)(F)F |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.807574 |
