| SpectraBase Spectrum ID |
1iUAfGraJjP |
| Name |
1,1,1,2,3,5,5,6,6,6-Decafluoro-4,4-bis(trifluoromethyl)hex-2-ene |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
399.974450608 u |
| Formula |
C8F16 |
| InChI |
InChI=1S/C8F16/c9-1(2(10)4(11,12)13)3(6(16,17)18,7(19,20)21)5(14,15)8(22,23)24/b2-1+ |
| InChIKey |
ZNTGXSHTONSNFF-OWOJBTEDSA-N |
| Molecular Weight |
400.062 g/mol |
| SMILES |
C(\C(=C\(C(F)(F)F)F)F)(C(F)(F)F)(C(F)(F)F)C(C(F)(F)F)(F)F |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.928528 |
