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Glutaric acid, 2,2,3,3,4,4,5,5-octafluoropentyl but-3-yn-2-yl ester

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Glutaric acid, 2,2,3,3,4,4,5,5-octafluoropentyl but-3-yn-2-yl ester
SpectraBase Compound ID 2y08G0QOcZn
InChI InChI=1S/C14H14F8O4/c1-3-8(2)26-10(24)6-4-5-9(23)25-7-12(17,18)14(21,22)13(19,20)11(15)16/h1,8,11H,4-7H2,2H3
InChIKey DYCBTGNTWMDIMN-UHFFFAOYSA-N
Mol Weight 398.25 g/mol
Molecular Formula C14H14F8O4
Exact Mass 398.076434 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3t270KqvBTI
Name Glutaric acid, 2,2,3,3,4,4,5,5-octafluoropentyl but-3-yn-2-yl ester
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 398.076434231 u
Formula C14H14F8O4
InChI InChI=1S/C14H14F8O4/c1-3-8(2)26-10(24)6-4-5-9(23)25-7-12(17,18)14(21,22)13(19,20)11(15)16/h1,8,11H,4-7H2,2H3
InChIKey DYCBTGNTWMDIMN-UHFFFAOYSA-N
Molecular Weight 398.249 g/mol
SMILES C(CCC(OCC(C(C(C(F)F)(F)F)(F)F)(F)F)=O)C(OC(C)C#C)=O