| SpectraBase Spectrum ID |
7ZuQwHjo5N4 |
| Name |
(2-Iodanyl-3,3-dimethyl-butyl) 2,2,2-tris(fluoranyl)ethanoate |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
323.983409113 u |
| Formula |
C8H12F3IO2 |
| InChI |
InChI=1S/C8H12F3IO2/c1-7(2,3)5(12)4-14-6(13)8(9,10)11/h5H,4H2,1-3H3 |
| InChIKey |
ULJHGSUYXMAVAW-UHFFFAOYSA-N |
| Molecular Weight |
324.082 g/mol |
| SMILES |
C(C(F)(F)F)(=O)OCC(C(C)(C)C)I |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.91743 |
