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Fumaric acid, 2-fluorophenyl tetradecyl ester

View entire compound with spectra: 1 NMR

Fumaric acid, 2-fluorophenyl tetradecyl ester
SpectraBase Compound ID GrP4Xs7TQoV
InChI InChI=1S/C24H35FO4/c1-2-3-4-5-6-7-8-9-10-11-12-15-20-28-23(26)18-19-24(27)29-22-17-14-13-16-21(22)25/h13-14,16-19H,2-12,15,20H2,1H3/b19-18+
InChIKey MVLCIGAJNRQJTJ-VHEBQXMUSA-N
Mol Weight 406.5 g/mol
Molecular Formula C24H35FO4
Exact Mass 406.251938 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Cm0pxioOoMs
Name Fumaric acid, 2-fluorophenyl tetradecyl ester
Comments Computed using HOSE algorithm
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Exact Mass 406.251937766 u
Formula C24H35FO4
InChI InChI=1S/C24H35FO4/c1-2-3-4-5-6-7-8-9-10-11-12-15-20-28-23(26)18-19-24(27)29-22-17-14-13-16-21(22)25/h13-14,16-19H,2-12,15,20H2,1H3/b19-18+
InChIKey MVLCIGAJNRQJTJ-VHEBQXMUSA-N
Molecular Weight 406.538 g/mol
SMILES C1(=C(C=CC=C1)OC(\C=C\C(OCCCCCCCCCCCCCC)=O)=O)F