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

*Links on SpectraBase are not permalinks.

Phthalic acid, 1-(2,6-difluorophenyl)ethyl nonyl ester

View entire compound with spectra: 1 NMR

Phthalic acid, 1-(2,6-difluorophenyl)ethyl nonyl ester
SpectraBase Compound ID 6QQWiGAsxRl
InChI InChI=1S/C25H30F2O4/c1-3-4-5-6-7-8-11-17-30-24(28)19-13-9-10-14-20(19)25(29)31-18(2)23-21(26)15-12-16-22(23)27/h9-10,12-16,18H,3-8,11,17H2,1-2H3
InChIKey WOQKOLBZJFXOPQ-UHFFFAOYSA-N
Mol Weight 432.51 g/mol
Molecular Formula C25H30F2O4
Exact Mass 432.211216 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 2QLo7ImRgMl
Name Phthalic acid, 1-(2,6-difluorophenyl)ethyl nonyl ester
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 432.211215768 u
Formula C25H30F2O4
InChI InChI=1S/C25H30F2O4/c1-3-4-5-6-7-8-11-17-30-24(28)19-13-9-10-14-20(19)25(29)31-18(2)23-21(26)15-12-16-22(23)27/h9-10,12-16,18H,3-8,11,17H2,1-2H3
InChIKey WOQKOLBZJFXOPQ-UHFFFAOYSA-N
Molecular Weight 432.508 g/mol
SMILES C(C1=CC=CC=C1C(=O)OC(C)C1=C(C=CC=C1F)F)(OCCCCCCCCC)=O