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Glutaric acid, 4-(trifluoromethoxy)benzyl undecyl ester

View entire compound with spectra: 1 NMR

Glutaric acid, 4-(trifluoromethoxy)benzyl undecyl ester
SpectraBase Compound ID 3e9dqMmCbss
InChI InChI=1S/C24H35F3O5/c1-2-3-4-5-6-7-8-9-10-18-30-22(28)12-11-13-23(29)31-19-20-14-16-21(17-15-20)32-24(25,26)27/h14-17H,2-13,18-19H2,1H3
InChIKey CHEUWTNBUAKENO-UHFFFAOYSA-N
Mol Weight 460.5 g/mol
Molecular Formula C24H35F3O5
Exact Mass 460.243659 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID H7GYH8qWIyQ
Name Glutaric acid, 4-(trifluoromethoxy)benzyl undecyl ester
Comments Computed using HOSE algorithm
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Exact Mass 460.243658711 u
Formula C24H35F3O5
InChI InChI=1S/C24H35F3O5/c1-2-3-4-5-6-7-8-9-10-18-30-22(28)12-11-13-23(29)31-19-20-14-16-21(17-15-20)32-24(25,26)27/h14-17H,2-13,18-19H2,1H3
InChIKey CHEUWTNBUAKENO-UHFFFAOYSA-N
Molecular Weight 460.534 g/mol
SMILES C(OCC1=CC=C(OC(F)(F)F)C=C1)(=O)CCCC(OCCCCCCCCCCC)=O