| SpectraBase Compound ID | GENecBQyjxo |
|---|---|
| InChI | InChI=1S/C3H2ClF3O/c4-2(8)1-3(5,6)7/h1H2 |
| InChIKey | VOSQLWCTKGQTAY-UHFFFAOYSA-N |
| Mol Weight | 146.5 g/mol |
| Molecular Formula | C3H2ClF3O |
| Exact Mass | 145.974627 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | Ga2AVOwKp7y |
|---|---|
| Name | Propanoyl chloride, 3,3,3-trifluoro- |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 145.974626872 u |
| Formula | C3H2ClF3O |
| InChI | InChI=1S/C3H2ClF3O/c4-2(8)1-3(5,6)7/h1H2 |
| InChIKey | VOSQLWCTKGQTAY-UHFFFAOYSA-N |
| Molecular Weight | 146.496 g/mol |
| SMILES | C(=O)(CC(F)(F)F)Cl |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.959917 |