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Glutaric acid, 2,2,3,3,4,4,5,5-octafluoropentyl 4-methylpent-2-yl ester

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Glutaric acid, 2,2,3,3,4,4,5,5-octafluoropentyl 4-methylpent-2-yl ester
SpectraBase Compound ID AJm4hM5wd8J
InChI InChI=1S/C16H22F8O4/c1-9(2)7-10(3)28-12(26)6-4-5-11(25)27-8-14(19,20)16(23,24)15(21,22)13(17)18/h9-10,13H,4-8H2,1-3H3
InChIKey GNZYBAYJDAJZNI-UHFFFAOYSA-N
Mol Weight 430.34 g/mol
Molecular Formula C16H22F8O4
Exact Mass 430.139034 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID riZNfKCsJV
Name Glutaric acid, 2,2,3,3,4,4,5,5-octafluoropentyl 4-methylpent-2-yl ester
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 430.139034488 u
Formula C16H22F8O4
InChI InChI=1S/C16H22F8O4/c1-9(2)7-10(3)28-12(26)6-4-5-11(25)27-8-14(19,20)16(23,24)15(21,22)13(17)18/h9-10,13H,4-8H2,1-3H3
InChIKey GNZYBAYJDAJZNI-UHFFFAOYSA-N
Molecular Weight 430.335 g/mol
SMILES C(CCC(OC(C)CC(C)C)=O)C(OCC(C(C(C(F)F)(F)F)(F)F)(F)F)=O