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Succinic acid, 4-trifluoromethylbenzyl undecyl ester

View entire compound with spectra: 1 NMR

Succinic acid, 4-trifluoromethylbenzyl undecyl ester
SpectraBase Compound ID HxBM3jqKphl
InChI InChI=1S/C23H33F3O4/c1-2-3-4-5-6-7-8-9-10-17-29-21(27)15-16-22(28)30-18-19-11-13-20(14-12-19)23(24,25)26/h11-14H,2-10,15-18H2,1H3
InChIKey OUTJKTOMALBTRY-UHFFFAOYSA-N
Mol Weight 430.5 g/mol
Molecular Formula C23H33F3O4
Exact Mass 430.233094 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DDf1TmOO3EA
Name Succinic acid, 4-trifluoromethylbenzyl undecyl ester
Comments Computed using HOSE algorithm
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Exact Mass 430.233094028 u
Formula C23H33F3O4
InChI InChI=1S/C23H33F3O4/c1-2-3-4-5-6-7-8-9-10-17-29-21(27)15-16-22(28)30-18-19-11-13-20(14-12-19)23(24,25)26/h11-14H,2-10,15-18H2,1H3
InChIKey OUTJKTOMALBTRY-UHFFFAOYSA-N
Molecular Weight 430.508 g/mol
SMILES C(C1=CC=C(COC(=O)CCC(OCCCCCCCCCCC)=O)C=C1)(F)(F)F