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Glutaric acid, 2-(2,4-dichlorophenyl)ethyl ethyl ester

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Glutaric acid, 2-(2,4-dichlorophenyl)ethyl ethyl ester
SpectraBase Compound ID DVA99u0yYnf
InChI InChI=1S/C15H18Cl2O4/c1-2-20-14(18)4-3-5-15(19)21-9-8-11-6-7-12(16)10-13(11)17/h6-7,10H,2-5,8-9H2,1H3
InChIKey WBWDKVRBRZDKTJ-UHFFFAOYSA-N
Mol Weight 333.21 g/mol
Molecular Formula C15H18Cl2O4
Exact Mass 332.058214 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID DKkrt0ahYNe
Name Glutaric acid, 2-(2,4-dichlorophenyl)ethyl ethyl ester
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 332.058214456 u
Formula C15H18Cl2O4
InChI InChI=1S/C15H18Cl2O4/c1-2-20-14(18)4-3-5-15(19)21-9-8-11-6-7-12(16)10-13(11)17/h6-7,10H,2-5,8-9H2,1H3
InChIKey WBWDKVRBRZDKTJ-UHFFFAOYSA-N
Molecular Weight 333.211 g/mol
SMILES C(OCCC1=CC=C(C=C1Cl)Cl)(=O)CCCC(OCC)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.862878