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Glutaric acid, 1-(pentafluorophenyl)ethyl undecyl ester

View entire compound with spectra: 1 NMR

Glutaric acid, 1-(pentafluorophenyl)ethyl undecyl ester
SpectraBase Compound ID gYTo9Buqxu
InChI InChI=1S/C24H33F5O4/c1-3-4-5-6-7-8-9-10-11-15-32-17(30)13-12-14-18(31)33-16(2)19-20(25)22(27)24(29)23(28)21(19)26/h16H,3-15H2,1-2H3
InChIKey PPBMIZAOOUGRRK-UHFFFAOYSA-N
Mol Weight 480.5 g/mol
Molecular Formula C24H33F5O4
Exact Mass 480.2299 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DuHZ9CCUjMI
Name Glutaric acid, 1-(pentafluorophenyl)ethyl undecyl ester
Comments Computed using HOSE algorithm
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Exact Mass 480.229900354 u
Formula C24H33F5O4
InChI InChI=1S/C24H33F5O4/c1-3-4-5-6-7-8-9-10-11-15-32-17(30)13-12-14-18(31)33-16(2)19-20(25)22(27)24(29)23(28)21(19)26/h16H,3-15H2,1-2H3
InChIKey PPBMIZAOOUGRRK-UHFFFAOYSA-N
Molecular Weight 480.516 g/mol
SMILES C(OC(C)C1=C(C(=C(C(=C1F)F)F)F)F)(=O)CCCC(OCCCCCCCCCCC)=O