| SpectraBase Spectrum ID |
7gMiAQcRrTb |
| Name |
2-(4,4,5,5,6,6,7,7,8,8,9,9,9-Tridecafluoro-2-iodononyloxy)phenol |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
595.951790679 u |
| Formula |
C15H10F13IO2 |
| InChI |
InChI=1S/C15H10F13IO2/c16-10(17,5-7(29)6-31-9-4-2-1-3-8(9)30)11(18,19)12(20,21)13(22,23)14(24,25)15(26,27)28/h1-4,7,30H,5-6H2 |
| InChIKey |
UTMFDJFBZMBQBP-UHFFFAOYSA-N |
| Molecular Weight |
596.127 g/mol |
| SMILES |
C(C(C(C(F)(F)F)(F)F)(F)F)(C(C(CC(COC=1C(O)=CC=CC1)I)(F)F)(F)F)(F)F |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.879877 |
