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

*Links on SpectraBase are not permalinks.
2-Chlorobenzoic acid, 6-chlorohexyl ester
SpectraBase Compound ID BCGTyPJY8QX
InChI InChI=1S/C13H16Cl2O2/c14-9-5-1-2-6-10-17-13(16)11-7-3-4-8-12(11)15/h3-4,7-8H,1-2,5-6,9-10H2
InChIKey NPNCUNARNMASJO-UHFFFAOYSA-N
Mol Weight 275.18 g/mol
Molecular Formula C13H16Cl2O2
Exact Mass 274.052735 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 EfXX6OlgXgH
Name 2-Chlorobenzoic acid, 6-chlorohexyl ester
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 274.052735153 u
Formula C13H16Cl2O2
InChI InChI=1S/C13H16Cl2O2/c14-9-5-1-2-6-10-17-13(16)11-7-3-4-8-12(11)15/h3-4,7-8H,1-2,5-6,9-10H2
InChIKey NPNCUNARNMASJO-UHFFFAOYSA-N
SMILES C(C1=C(C=CC=C1)Cl)(OCCCCCCCl)=O