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Glutaric acid, 1-(2,6-difluorophenyl)ethyl undecyl ester

View entire compound with spectra: 1 NMR

Glutaric acid, 1-(2,6-difluorophenyl)ethyl undecyl ester
SpectraBase Compound ID 7YZslmgZuAX
InChI InChI=1S/C24H36F2O4/c1-3-4-5-6-7-8-9-10-11-18-29-22(27)16-13-17-23(28)30-19(2)24-20(25)14-12-15-21(24)26/h12,14-15,19H,3-11,13,16-18H2,1-2H3
InChIKey BUTYVOWWRXQNBT-UHFFFAOYSA-N
Mol Weight 426.5 g/mol
Molecular Formula C24H36F2O4
Exact Mass 426.258166 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HAJ0aqttGvv
Name Glutaric acid, 1-(2,6-difluorophenyl)ethyl undecyl ester
Comments Computed using HOSE algorithm
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Exact Mass 426.258165961 u
Formula C24H36F2O4
InChI InChI=1S/C24H36F2O4/c1-3-4-5-6-7-8-9-10-11-18-29-22(27)16-13-17-23(28)30-19(2)24-20(25)14-12-15-21(24)26/h12,14-15,19H,3-11,13,16-18H2,1-2H3
InChIKey BUTYVOWWRXQNBT-UHFFFAOYSA-N
Molecular Weight 426.545 g/mol
SMILES C(OC(C)C1=C(C=CC=C1F)F)(=O)CCCC(OCCCCCCCCCCC)=O