| SpectraBase Spectrum ID |
GSMLUL3AZTM |
| Name |
4,4,5,5,6,6,7,7,8,8,9,9,9-Tridecafluoro-2-iodo-2-nonen-1-ol |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
501.909925867 u |
| Formula |
C9H4F13IO |
| InChI |
InChI=1S/C9H4F13IO/c10-4(11,1-3(23)2-24)5(12,13)6(14,15)7(16,17)8(18,19)9(20,21)22/h1,24H,2H2/b3-1+ |
| InChIKey |
HUIAECWNXSPFSH-HNQUOIGGSA-N |
| Molecular Weight |
502.014 g/mol |
| SMILES |
C(F)(F)(F)C(F)(F)C(C(F)(F)C(F)(F)C(\C=C/(I)CO)(F)F)(F)F |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.816042 |
