SpectraBase Compound ID | 7bN1ygq1Fqv |
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InChI | InChI=1S/C6ClF11O/c7-1(19)2(8,9)3(10,11)4(12,13)5(14,15)6(16,17)18 |
InChIKey | CUPWBYQOIFVEGA-UHFFFAOYSA-N |
Mol Weight | 332.5 g/mol |
Molecular Formula | C6ClF11O |
Exact Mass | 331.946202 g/mol |
SpectraBase Spectrum ID | IIawGJ0mMHL |
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Name | Undecafluorohexanoyl chloride |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 331.946202112 u |
Formula | C6ClF11O |
InChI | InChI=1S/C6ClF11O/c7-1(19)2(8,9)3(10,11)4(12,13)5(14,15)6(16,17)18 |
InChIKey | CUPWBYQOIFVEGA-UHFFFAOYSA-N |
Molecular Weight | 332.500 g/mol |
SMILES | C(F)(F)(F)C(F)(F)C(C(C(C(Cl)=O)(F)F)(F)F)(F)F |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.974773 |