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Glutaric acid, 2-(pentafluorophenoxy)ethyl undecyl ester
SpectraBase Compound ID AvqxBFr0998
InChI InChI=1S/C24H33F5O5/c1-2-3-4-5-6-7-8-9-10-14-32-17(30)12-11-13-18(31)33-15-16-34-24-22(28)20(26)19(25)21(27)23(24)29/h2-16H2,1H3
InChIKey NZKYXSCUDCWMID-UHFFFAOYSA-N
Mol Weight 496.5 g/mol
Molecular Formula C24H33F5O5
Exact Mass 496.224815 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KljymKOu10A
Name Glutaric acid, 2-(pentafluorophenoxy)ethyl undecyl ester
Comments Computed using HOSE algorithm
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Exact Mass 496.224814973 u
Formula C24H33F5O5
InChI InChI=1S/C24H33F5O5/c1-2-3-4-5-6-7-8-9-10-14-32-17(30)12-11-13-18(31)33-15-16-34-24-22(28)20(26)19(25)21(27)23(24)29/h2-16H2,1H3
InChIKey NZKYXSCUDCWMID-UHFFFAOYSA-N
Molecular Weight 496.515 g/mol
SMILES C(OCCOC1=C(C(=C(C(=C1F)F)F)F)F)(=O)CCCC(OCCCCCCCCCCC)=O