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

*Links on SpectraBase are not permalinks.

Phthalic acid, 4-bromophenyl 3,5-difluorophenyl ester

View entire compound with spectra: 1 NMR

Phthalic acid, 4-bromophenyl 3,5-difluorophenyl ester
SpectraBase Compound ID 6BXK4gf5qTa
InChI InChI=1S/C20H11BrF2O4/c21-12-5-7-15(8-6-12)26-19(24)17-3-1-2-4-18(17)20(25)27-16-10-13(22)9-14(23)11-16/h1-11H
InChIKey VEJFBWCIMBJOFY-UHFFFAOYSA-N
Mol Weight 433.2 g/mol
Molecular Formula C20H11BrF2O4
Exact Mass 431.980878 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 Jo4Rf2DQ0fS
Name Phthalic acid, 4-bromophenyl 3,5-difluorophenyl ester
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 431.980878156 u
Formula C20H11BrF2O4
InChI InChI=1S/C20H11BrF2O4/c21-12-5-7-15(8-6-12)26-19(24)17-3-1-2-4-18(17)20(25)27-16-10-13(22)9-14(23)11-16/h1-11H
InChIKey VEJFBWCIMBJOFY-UHFFFAOYSA-N
Molecular Weight 433.205 g/mol
SMILES C1(=C(C=CC=C1)C(OC1=CC(=CC(=C1)F)F)=O)C(OC1=CC=C(C=C1)Br)=O