| SpectraBase Compound ID | F97zwthe7Bd |
|---|---|
| InChI | InChI=1S/C3Cl3F5/c4-1(7,2(5,8)9)3(6,10)11 |
| InChIKey | AIDLQDHQDQZVQM-UHFFFAOYSA-N |
| Mol Weight | 237.38 g/mol |
| Molecular Formula | C3Cl3F5 |
| Exact Mass | 235.898574 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | E7Ls4AVGnNE |
|---|---|
| Name | 1,1,2,3,3-Pentafluoro-1,2,3-trichloropropane |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 235.898573915 u |
| Formula | C3Cl3F5 |
| InChI | InChI=1S/C3Cl3F5/c4-1(7,2(5,8)9)3(6,10)11 |
| InChIKey | AIDLQDHQDQZVQM-UHFFFAOYSA-N |
| Molecular Weight | 237.384 g/mol |
| SMILES | C(F)(F)(Cl)C(F)(Cl)C(F)(F)Cl |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.856602 |