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Succinic acid, 3,4-difluorobenzyl dodecyl ester

View entire compound with spectra: 1 NMR

Succinic acid, 3,4-difluorobenzyl dodecyl ester
SpectraBase Compound ID FXRnsIG0QbH
InChI InChI=1S/C23H34F2O4/c1-2-3-4-5-6-7-8-9-10-11-16-28-22(26)14-15-23(27)29-18-19-12-13-20(24)21(25)17-19/h12-13,17H,2-11,14-16,18H2,1H3
InChIKey WDZLGLQEWRNDLH-UHFFFAOYSA-N
Mol Weight 412.5 g/mol
Molecular Formula C23H34F2O4
Exact Mass 412.242516 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9BLhylK2aDB
Name Succinic acid, 3,4-difluorobenzyl dodecyl ester
Comments Computed using HOSE algorithm
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Exact Mass 412.242515897 u
Formula C23H34F2O4
InChI InChI=1S/C23H34F2O4/c1-2-3-4-5-6-7-8-9-10-11-16-28-22(26)14-15-23(27)29-18-19-12-13-20(24)21(25)17-19/h12-13,17H,2-11,14-16,18H2,1H3
InChIKey WDZLGLQEWRNDLH-UHFFFAOYSA-N
Molecular Weight 412.518 g/mol
SMILES C(CCC(OCC1=CC(=C(C=C1)F)F)=O)(OCCCCCCCCCCCC)=O