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Glutaric acid, 2,2,3,3,4,4,5,5-octafluoropentyl 2,2,3,3,3-pentafluoropropyl ester
SpectraBase Compound ID Cg3fQ1HsYBZ
InChI InChI=1S/C13H11F13O4/c14-8(15)11(20,21)12(22,23)9(16,17)4-29-6(27)2-1-3-7(28)30-5-10(18,19)13(24,25)26/h8H,1-5H2
InChIKey YBCNCCRUDNJINL-UHFFFAOYSA-N
Mol Weight 478.21 g/mol
Molecular Formula C13H11F13O4
Exact Mass 478.044975 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID AmG1VHV45ac
Name Glutaric acid, 2,2,3,3,4,4,5,5-octafluoropentyl 2,2,3,3,3-pentafluoropropyl ester
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 478.044974949 u
Formula C13H11F13O4
InChI InChI=1S/C13H11F13O4/c14-8(15)11(20,21)12(22,23)9(16,17)4-29-6(27)2-1-3-7(28)30-5-10(18,19)13(24,25)26/h8H,1-5H2
InChIKey YBCNCCRUDNJINL-UHFFFAOYSA-N
Molecular Weight 478.206 g/mol
SMILES C(CCC(OCC(C(C(C(F)F)(F)F)(F)F)(F)F)=O)C(OCC(C(F)(F)F)(F)F)=O