SpectraBase Compound ID | 1v3aycyXSWg |
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InChI | InChI=1S/C3H2ClF5/c4-1(5)3(8,9)2(6)7/h1-2H |
InChIKey | FXSNEEBOGAOVIM-UHFFFAOYSA-N |
Mol Weight | 168.49 g/mol |
Molecular Formula | C3H2ClF5 |
Exact Mass | 167.976519 g/mol |
SpectraBase Spectrum ID | IO6fqmM4OnJ |
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Name | 1-Chloro-1,2,2,3,3-pentafluoropropane |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 167.976518579 u |
Formula | C3H2ClF5 |
InChI | InChI=1S/C3H2ClF5/c4-1(5)3(8,9)2(6)7/h1-2H |
InChIKey | FXSNEEBOGAOVIM-UHFFFAOYSA-N |
Molecular Weight | 168.494 g/mol |
SMILES | C(F)(F)C(C(F)Cl)(F)F |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.827085 |