| SpectraBase Compound ID | BAbnBTjhryi |
|---|---|
| InChI | InChI=1S/C3Cl5F3/c4-1(5,2(6,7)8)3(9,10)11 |
| InChIKey | GKXWTRSVUPXQMM-UHFFFAOYSA-N |
| Mol Weight | 270.3 g/mol |
| Molecular Formula | C3Cl5F3 |
| Exact Mass | 267.839473 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | BwbtGG9ZGOu |
|---|---|
| Name | 2,2,3,3,3-Pentachloro-1,1,1-trifluoropropane |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 267.839472989 u |
| Formula | C3Cl5F3 |
| InChI | InChI=1S/C3Cl5F3/c4-1(5,2(6,7)8)3(9,10)11 |
| InChIKey | GKXWTRSVUPXQMM-UHFFFAOYSA-N |
| Molecular Weight | 270.293 g/mol |
| SMILES | C(Cl)(C(F)(F)F)(C(Cl)(Cl)Cl)Cl |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.896565 |