| SpectraBase Compound ID | Ho6gYY0Ce9l |
|---|---|
| InChI | InChI=1S/C3HF5O/c4-2(5,1-9)3(6,7)8/h1H |
| InChIKey | IRPGOXJVTQTAAN-UHFFFAOYSA-N |
| Mol Weight | 148.032 g/mol |
| Molecular Formula | C3HF5O |
| Exact Mass | 147.994755 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | JA2bCx0PhYZ |
|---|---|
| Name | Propanal, pentafluoro- |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 147.994755466 u |
| Formula | C3HF5O |
| InChI | InChI=1S/C3HF5O/c4-2(5,1-9)3(6,7)8/h1H |
| InChIKey | IRPGOXJVTQTAAN-UHFFFAOYSA-N |
| Molecular Weight | 148.032 g/mol |
| SMILES | C(C(C=O)(F)F)(F)(F)F |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.957365 |