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Succinic acid, 1-(2,6-difluorophenyl)ethyl octyl ester

View entire compound with spectra: 1 NMR

Succinic acid, 1-(2,6-difluorophenyl)ethyl octyl ester
SpectraBase Compound ID E20j0Zebk7X
InChI InChI=1S/C20H28F2O4/c1-3-4-5-6-7-8-14-25-18(23)12-13-19(24)26-15(2)20-16(21)10-9-11-17(20)22/h9-11,15H,3-8,12-14H2,1-2H3
InChIKey WMVBWEPBFGZFOY-UHFFFAOYSA-N
Mol Weight 370.44 g/mol
Molecular Formula C20H28F2O4
Exact Mass 370.195566 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2nI5bOyYamc
Name Succinic acid, 1-(2,6-difluorophenyl)ethyl octyl ester
Comments Computed using HOSE algorithm
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Exact Mass 370.195565704 u
Formula C20H28F2O4
InChI InChI=1S/C20H28F2O4/c1-3-4-5-6-7-8-14-25-18(23)12-13-19(24)26-15(2)20-16(21)10-9-11-17(20)22/h9-11,15H,3-8,12-14H2,1-2H3
InChIKey WMVBWEPBFGZFOY-UHFFFAOYSA-N
Molecular Weight 370.437 g/mol
SMILES C(CCC(OC(C1=C(C=CC=C1F)F)C)=O)(OCCCCCCCC)=O