| SpectraBase Spectrum ID |
IH8CLTviRDW |
| Name |
2,3,4,5-Tetrakis-(trifluoromethyl)-1,6-benzodioxocine |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
432.001967323 u |
| Formula |
C14H4F12O2 |
| InChI |
InChI=1S/C14H4F12O2/c15-11(16,17)7-8(12(18,19)20)10(14(24,25)26)28-6-4-2-1-3-5(6)27-9(7)13(21,22)23/h1-4H/b9-7+,10-8+ |
| InChIKey |
JAVZXEXREYOUQW-FIFLTTCUSA-N |
| Molecular Weight |
432.165 g/mol |
| SMILES |
C(F)(\C1=C/(C(F)(F)F)\C(C(F)(F)F)=C\(C(F)(F)F)OC2=CC=CC=C2O1)(F)F |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.904146 |
