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Glutaric acid, 2,2-dichloroethyl 2-methyl-4-chlorophenyl ester

View entire compound with spectra: 1 FTIR

Glutaric acid, 2,2-dichloroethyl 2-methyl-4-chlorophenyl ester
SpectraBase Compound ID 9jgeuVdBcOR
InChI InChI=1S/C14H15Cl3O4/c1-9-7-10(15)5-6-11(9)21-14(19)4-2-3-13(18)20-8-12(16)17/h5-7,12H,2-4,8H2,1H3
InChIKey DDOATBNWISWWFT-UHFFFAOYSA-N
Mol Weight 353.63 g/mol
Molecular Formula C14H15Cl3O4
Exact Mass 352.003592 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 3vLgpJCvByo
Name Glutaric acid, 2,2-dichloroethyl 2-methyl-4-chlorophenyl ester
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 352.003592059 u
Formula C14H15Cl3O4
InChI InChI=1S/C14H15Cl3O4/c1-9-7-10(15)5-6-11(9)21-14(19)4-2-3-13(18)20-8-12(16)17/h5-7,12H,2-4,8H2,1H3
InChIKey DDOATBNWISWWFT-UHFFFAOYSA-N
Molecular Weight 353.629 g/mol
SMILES C(CCC(OCC(Cl)Cl)=O)C(OC1=CC=C(C=C1C)Cl)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.859594