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Glutaric acid, dodecyl 2-fluorophenyl ester

View entire compound with spectra: 1 NMR

Glutaric acid, dodecyl 2-fluorophenyl ester
SpectraBase Compound ID J6Qw1RIUkpq
InChI InChI=1S/C23H35FO4/c1-2-3-4-5-6-7-8-9-10-13-19-27-22(25)17-14-18-23(26)28-21-16-12-11-15-20(21)24/h11-12,15-16H,2-10,13-14,17-19H2,1H3
InChIKey AYNPPQZDPGOOFA-UHFFFAOYSA-N
Mol Weight 394.5 g/mol
Molecular Formula C23H35FO4
Exact Mass 394.251938 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KwGoHYyMxyW
Name Glutaric acid, dodecyl 2-fluorophenyl ester
Comments Computed using HOSE algorithm
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Exact Mass 394.251937766 u
Formula C23H35FO4
InChI InChI=1S/C23H35FO4/c1-2-3-4-5-6-7-8-9-10-13-19-27-22(25)17-14-18-23(26)28-21-16-12-11-15-20(21)24/h11-12,15-16H,2-10,13-14,17-19H2,1H3
InChIKey AYNPPQZDPGOOFA-UHFFFAOYSA-N
Molecular Weight 394.527 g/mol
SMILES CCCCCCCCCCCCOC(CCCC(OC1=CC=CC=C1F)=O)=O