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Glutaric acid, 2-(2-fluorophenyl)ethyl tetradecyl ester

View entire compound with spectra: 1 NMR

Glutaric acid, 2-(2-fluorophenyl)ethyl tetradecyl ester
SpectraBase Compound ID 2BiiD8hEofF
InChI InChI=1S/C27H43FO4/c1-2-3-4-5-6-7-8-9-10-11-12-15-22-31-26(29)19-16-20-27(30)32-23-21-24-17-13-14-18-25(24)28/h13-14,17-18H,2-12,15-16,19-23H2,1H3
InChIKey PONSIDAVHGXIPE-UHFFFAOYSA-N
Mol Weight 450.6 g/mol
Molecular Formula C27H43FO4
Exact Mass 450.314538 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9FW4ouauPQ6
Name Glutaric acid, 2-(2-fluorophenyl)ethyl tetradecyl ester
Comments Computed using HOSE algorithm
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Exact Mass 450.314538024 u
Formula C27H43FO4
InChI InChI=1S/C27H43FO4/c1-2-3-4-5-6-7-8-9-10-11-12-15-22-31-26(29)19-16-20-27(30)32-23-21-24-17-13-14-18-25(24)28/h13-14,17-18H,2-12,15-16,19-23H2,1H3
InChIKey PONSIDAVHGXIPE-UHFFFAOYSA-N
Molecular Weight 450.635 g/mol
SMILES C(OCCC1=C(C=CC=C1)F)(=O)CCCC(OCCCCCCCCCCCCCC)=O