| SpectraBase Compound ID | 6f34u8xVU28 |
|---|---|
| InChI | InChI=1S/C5H4F8O2/c6-3(7,5(11,12)13)1(14)2(15)4(8,9)10/h1-2,14-15H |
| InChIKey | HMMPASPONSMAMN-UHFFFAOYSA-N |
| Mol Weight | 248.07 g/mol |
| Molecular Formula | C5H4F8O2 |
| Exact Mass | 248.008355 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 3TjRWXaepTd |
|---|---|
| Name | 1,1,1,4,4,5,5,5-Octafluoropentane-2,3-diol |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 248.008354671 u |
| Formula | C5H4F8O2 |
| InChI | InChI=1S/C5H4F8O2/c6-3(7,5(11,12)13)1(14)2(15)4(8,9)10/h1-2,14-15H |
| InChIKey | HMMPASPONSMAMN-UHFFFAOYSA-N |
| Molecular Weight | 248.072 g/mol |
| SMILES | C(C(C(C(F)(F)F)O)O)(C(F)(F)F)(F)F |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.962209 |