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1,2-Cyclohexanedicarboxylic acid, 2-fluorophenyl decyl ester

View entire compound with spectra: 1 NMR

1,2-Cyclohexanedicarboxylic acid, 2-fluorophenyl decyl ester
SpectraBase Compound ID FKuYTXfjioG
InChI InChI=1S/C24H35FO4/c1-2-3-4-5-6-7-8-13-18-28-23(26)19-14-9-10-15-20(19)24(27)29-22-17-12-11-16-21(22)25/h11-12,16-17,19-20H,2-10,13-15,18H2,1H3
InChIKey RCVJYHJQQZIGFX-UHFFFAOYSA-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 LdfmMyunhna
Name 1,2-Cyclohexanedicarboxylic acid, 2-fluorophenyl decyl ester
Comments Computed using HOSE algorithm
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Exact Mass 406.251937766 u
Formula C24H35FO4
InChI InChI=1S/C24H35FO4/c1-2-3-4-5-6-7-8-13-18-28-23(26)19-14-9-10-15-20(19)24(27)29-22-17-12-11-16-21(22)25/h11-12,16-17,19-20H,2-10,13-15,18H2,1H3
InChIKey RCVJYHJQQZIGFX-UHFFFAOYSA-N
Molecular Weight 406.538 g/mol
SMILES C1=C(C(=CC=C1)F)OC(C1CCCCC1C(OCCCCCCCCCC)=O)=O