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

*Links on SpectraBase are not permalinks.

Isophthalic acid, 2,5-dichlorophenyl nonyl ester

View entire compound with spectra: 1 NMR

Isophthalic acid, 2,5-dichlorophenyl nonyl ester
SpectraBase Compound ID DAmFLHzfyQ7
InChI InChI=1S/C23H26Cl2O4/c1-2-3-4-5-6-7-8-14-28-22(26)17-10-9-11-18(15-17)23(27)29-21-16-19(24)12-13-20(21)25/h9-13,15-16H,2-8,14H2,1H3
InChIKey UMITVXGQFBHTED-UHFFFAOYSA-N
Mol Weight 437.36 g/mol
Molecular Formula C23H26Cl2O4
Exact Mass 436.120815 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 BhshtpNlV6w
Name Isophthalic acid, 2,5-dichlorophenyl nonyl ester
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 436.120814713 u
Formula C23H26Cl2O4
InChI InChI=1S/C23H26Cl2O4/c1-2-3-4-5-6-7-8-14-28-22(26)17-10-9-11-18(15-17)23(27)29-21-16-19(24)12-13-20(21)25/h9-13,15-16H,2-8,14H2,1H3
InChIKey UMITVXGQFBHTED-UHFFFAOYSA-N
Molecular Weight 437.363 g/mol
SMILES C1=C(C(=CC=C1Cl)Cl)OC(=O)C1=CC(C(OCCCCCCCCC)=O)=CC=C1