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

View entire compound with spectra: 1 NMR

Glutaric acid, 1-(2,6-difluorophenyl)ethyl tridecyl ester
SpectraBase Compound ID BDRra9ycFtQ
InChI InChI=1S/C26H40F2O4/c1-3-4-5-6-7-8-9-10-11-12-13-20-31-24(29)18-15-19-25(30)32-21(2)26-22(27)16-14-17-23(26)28/h14,16-17,21H,3-13,15,18-20H2,1-2H3
InChIKey UWKOEWWNQVVUNJ-UHFFFAOYSA-N
Mol Weight 454.6 g/mol
Molecular Formula C26H40F2O4
Exact Mass 454.289466 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8fhdtQLZ1Qh
Name Glutaric acid, 1-(2,6-difluorophenyl)ethyl tridecyl ester
Comments Computed using HOSE algorithm
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Exact Mass 454.289466090 u
Formula C26H40F2O4
InChI InChI=1S/C26H40F2O4/c1-3-4-5-6-7-8-9-10-11-12-13-20-31-24(29)18-15-19-25(30)32-21(2)26-22(27)16-14-17-23(26)28/h14,16-17,21H,3-13,15,18-20H2,1-2H3
InChIKey UWKOEWWNQVVUNJ-UHFFFAOYSA-N
Molecular Weight 454.599 g/mol
SMILES C(OC(C)C1=C(C=CC=C1F)F)(=O)CCCC(OCCCCCCCCCCCCC)=O