| SpectraBase Spectrum ID |
EK5Js14vl5R |
| Name |
1-Bromo-2,3,4,5-tetrafluoro-6-(1-trifluoromethyltetrafluoroethyl)benzene |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
395.900772793 u |
| Formula |
C9BrF11 |
| InChI |
InChI=1S/C9BrF11/c10-2-5(13)3(11)1(4(12)6(2)14)7(15,8(16,17)18)9(19,20)21 |
| InChIKey |
JCDBNDBAZIQBET-UHFFFAOYSA-N |
| Molecular Weight |
396.985 g/mol |
| SMILES |
C1(=C(C(=C(C(=C1C(F)(C(F)(F)F)C(F)(F)F)F)F)Br)F)F |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.811047 |
