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Succinic acid, 2,2,3,3,4,4,5,5-octafluoropentyl 3-methylbut-2-yl ester

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Succinic acid, 2,2,3,3,4,4,5,5-octafluoropentyl 3-methylbut-2-yl ester
SpectraBase Compound ID sEsGpK5F9Y
InChI InChI=1S/C14H18F8O4/c1-7(2)8(3)26-10(24)5-4-9(23)25-6-12(17,18)14(21,22)13(19,20)11(15)16/h7-8,11H,4-6H2,1-3H3
InChIKey VJQGNQKVBWZVRR-UHFFFAOYSA-N
Mol Weight 402.28 g/mol
Molecular Formula C14H18F8O4
Exact Mass 402.107734 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7abVhZ26sea
Name Succinic acid, 2,2,3,3,4,4,5,5-octafluoropentyl 3-methylbut-2-yl ester
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 402.107734360 u
Formula C14H18F8O4
InChI InChI=1S/C14H18F8O4/c1-7(2)8(3)26-10(24)5-4-9(23)25-6-12(17,18)14(21,22)13(19,20)11(15)16/h7-8,11H,4-6H2,1-3H3
InChIKey VJQGNQKVBWZVRR-UHFFFAOYSA-N
Molecular Weight 402.281 g/mol
SMILES C(CC(OCC(C(C(C(F)F)(F)F)(F)F)(F)F)=O)C(OC(C(C)C)C)=O