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2,2,3,3,3-Pentafluoropropanoic 3-methyl-4-((2,2,3,3,3-pentafluoropropanoyl)oxy)benzoic anhydride
SpectraBase Compound ID 1AwA1DB3z4M
InChI InChI=1S/C14H6F10O5/c1-5-4-6(8(25)29-10(27)12(17,18)14(22,23)24)2-3-7(5)28-9(26)11(15,16)13(19,20)21/h2-4H,1H3
InChIKey DXRJODCCOBUORV-UHFFFAOYSA-N
Mol Weight 444.18 g/mol
Molecular Formula C14H6F10O5
Exact Mass 444.005555 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID C7Q7HhmwqTi
Name 2,2,3,3,3-Pentafluoropropanoic 3-methyl-4-((2,2,3,3,3-pentafluoropropanoyl)oxy)benzoic anhydride
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 444.005554918 u
Formula C14H6F10O5
InChI InChI=1S/C14H6F10O5/c1-5-4-6(8(25)29-10(27)12(17,18)14(22,23)24)2-3-7(5)28-9(26)11(15,16)13(19,20)21/h2-4H,1H3
InChIKey DXRJODCCOBUORV-UHFFFAOYSA-N
Molecular Weight 444.181 g/mol
SMILES C1(=C(C=C(C=C1)C(OC(=O)C(F)(F)C(F)(F)F)=O)C)OC(C(F)(C(F)(F)F)F)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.969851