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

*Links on SpectraBase are not permalinks.
Glutaric acid, 2,4,6-trichlorophenyl 3,5-dichlorophenyl ester
SpectraBase Compound ID 3wLztCfXetN
InChI InChI=1S/C17H11Cl5O4/c18-9-4-10(19)6-12(5-9)25-15(23)2-1-3-16(24)26-17-13(21)7-11(20)8-14(17)22/h4-8H,1-3H2
InChIKey YWBFPIVIQIAEAP-UHFFFAOYSA-N
Mol Weight 456.5 g/mol
Molecular Formula C17H11Cl5O4
Exact Mass 453.909997 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 Camyjh3i4iP
Name Glutaric acid, 2,4,6-trichlorophenyl 3,5-dichlorophenyl ester
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 453.909997330 u
Formula C17H11Cl5O4
InChI InChI=1S/C17H11Cl5O4/c18-9-4-10(19)6-12(5-9)25-15(23)2-1-3-16(24)26-17-13(21)7-11(20)8-14(17)22/h4-8H,1-3H2
InChIKey YWBFPIVIQIAEAP-UHFFFAOYSA-N
Molecular Weight 456.536 g/mol
SMILES C(CCC(OC1=C(C=C(C=C1Cl)Cl)Cl)=O)C(OC1=CC(=CC(=C1)Cl)Cl)=O