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Glutaric acid, dodecyl 2-(4-fluorophenyl)ethyl ester

View entire compound with spectra: 1 NMR

Glutaric acid, dodecyl 2-(4-fluorophenyl)ethyl ester
SpectraBase Compound ID K9bbnFR5lXj
InChI InChI=1S/C25H39FO4/c1-2-3-4-5-6-7-8-9-10-11-20-29-24(27)13-12-14-25(28)30-21-19-22-15-17-23(26)18-16-22/h15-18H,2-14,19-21H2,1H3
InChIKey IYHKUXNGZRBWKP-UHFFFAOYSA-N
Mol Weight 422.6 g/mol
Molecular Formula C25H39FO4
Exact Mass 422.283238 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 60b02yHkrt4
Name Glutaric acid, dodecyl 2-(4-fluorophenyl)ethyl ester
Comments Computed using HOSE algorithm
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Exact Mass 422.283237895 u
Formula C25H39FO4
InChI InChI=1S/C25H39FO4/c1-2-3-4-5-6-7-8-9-10-11-20-29-24(27)13-12-14-25(28)30-21-19-22-15-17-23(26)18-16-22/h15-18H,2-14,19-21H2,1H3
InChIKey IYHKUXNGZRBWKP-UHFFFAOYSA-N
Molecular Weight 422.581 g/mol
SMILES C(OCCC1=CC=C(C=C1)F)(=O)CCCC(OCCCCCCCCCCCC)=O