| SpectraBase Compound ID | DJTsEwUbVZR |
|---|---|
| InChI | InChI=1S/C5H2F6/c6-3(7)1-2-4(8,9)5(3,10)11/h1-2H |
| InChIKey | FHQKLIHFKVAEEP-UHFFFAOYSA-N |
| Mol Weight | 176.06 g/mol |
| Molecular Formula | C5H2F6 |
| Exact Mass | 176.006069 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 8PORTeOWQcM |
|---|---|
| Name | 3,3,4,4,5,5-Hexafluorocyclopentene |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 176.006069042 u |
| Formula | C5H2F6 |
| InChI | InChI=1S/C5H2F6/c6-3(7)1-2-4(8,9)5(3,10)11/h1-2H |
| InChIKey | FHQKLIHFKVAEEP-UHFFFAOYSA-N |
| Molecular Weight | 176.061 g/mol |
| SMILES | C1=CC(F)(F)C(C1(F)F)(F)F |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.897616 |