| SpectraBase Compound ID | AJyLxJwVJNv |
|---|---|
| InChI | InChI=1S/C6H8F2O2/c7-6(8)2-1-4(3-6)5(9)10/h4H,1-3H2,(H,9,10) |
| InChIKey | DXLZFZGHXIZHFB-UHFFFAOYSA-N |
| Mol Weight | 150.12 g/mol |
| Molecular Formula | C6H8F2O2 |
| Exact Mass | 150.049236 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | GGr7lRfe291 |
|---|---|
| Name | 3,3-Difluorocyclopentanecarboxylic acid |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 150.049235822 u |
| Formula | C6H8F2O2 |
| InChI | InChI=1S/C6H8F2O2/c7-6(8)2-1-4(3-6)5(9)10/h4H,1-3H2,(H,9,10) |
| InChIKey | DXLZFZGHXIZHFB-UHFFFAOYSA-N |
| Molecular Weight | 150.125 g/mol |
| SMILES | C1(F)(CC(CC1)C(=O)O)F |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.905696 |