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

*Links on SpectraBase are not permalinks.

Succinic acid, dodecyl 2,3,6-trichlorophenyl ester

View entire compound with spectra: 1 NMR

Succinic acid, dodecyl 2,3,6-trichlorophenyl ester
SpectraBase Compound ID GMVpiZnY2gz
InChI InChI=1S/C22H31Cl3O4/c1-2-3-4-5-6-7-8-9-10-11-16-28-19(26)14-15-20(27)29-22-18(24)13-12-17(23)21(22)25/h12-13H,2-11,14-16H2,1H3
InChIKey ZISPEBQCKRKILO-UHFFFAOYSA-N
Mol Weight 465.85 g/mol
Molecular Formula C22H31Cl3O4
Exact Mass 464.128793 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 A72e1CDYE3v
Name Succinic acid, dodecyl 2,3,6-trichlorophenyl ester
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 464.128792574 u
Formula C22H31Cl3O4
InChI InChI=1S/C22H31Cl3O4/c1-2-3-4-5-6-7-8-9-10-11-16-28-19(26)14-15-20(27)29-22-18(24)13-12-17(23)21(22)25/h12-13H,2-11,14-16H2,1H3
InChIKey ZISPEBQCKRKILO-UHFFFAOYSA-N
Molecular Weight 465.845 g/mol
SMILES C(C(OC1=C(C=CC(=C1Cl)Cl)Cl)=O)CC(OCCCCCCCCCCCC)=O