SpectraBase Spectrum ID |
23LcRhc8wGq |
Name |
(3,3,4,4,4-Pentafluoro-2-(perfluoroethyl)but-1-ene-1,1-diyl)dibenzene |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
416.062281952 u |
Formula |
C18H10F10 |
InChI |
InChI=1S/C18H10F10/c19-15(20,17(23,24)25)14(16(21,22)18(26,27)28)13(11-7-3-1-4-8-11)12-9-5-2-6-10-12/h1-10H |
InChIKey |
YPIMIZQLWRRDGH-UHFFFAOYSA-N |
Molecular Weight |
416.262 g/mol |
SMILES |
C(=C(C(F)(F)C(F)(F)F)C(C(F)(F)F)(F)F)(C1=CC=CC=C1)C1=CC=CC=C1 |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.89725 |