For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.

2,4-Difluorobenzoic acid, eicosyl ester

View entire compound with spectra: 1 NMR

2,4-Difluorobenzoic acid, eicosyl ester
SpectraBase Compound ID BMBU7SUOzfm
InChI InChI=1S/C27H44F2O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-22-31-27(30)25-21-20-24(28)23-26(25)29/h20-21,23H,2-19,22H2,1H3
InChIKey OLRQHJQNFSAIAJ-UHFFFAOYSA-N
Mol Weight 438.6 g/mol
Molecular Formula C27H44F2O2
Exact Mass 438.330937 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID cvtGOsNckc
Name 2,4-Difluorobenzoic acid, eicosyl ester
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 438.330936981 u
Formula C27H44F2O2
InChI InChI=1S/C27H44F2O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-22-31-27(30)25-21-20-24(28)23-26(25)29/h20-21,23H,2-19,22H2,1H3
InChIKey OLRQHJQNFSAIAJ-UHFFFAOYSA-N
Molecular Weight 438.644 g/mol
SMILES C(CCCCCCCCCOC(C1=C(C=C(C=C1)F)F)=O)CCCCCCCCCC