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Succinic acid, 2,2-dichloroethyl 3-methoxyphenyl ester

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Succinic acid, 2,2-dichloroethyl 3-methoxyphenyl ester
SpectraBase Compound ID Ilz2nJ4CnSG
InChI InChI=1S/C13H14Cl2O5/c1-18-9-3-2-4-10(7-9)20-13(17)6-5-12(16)19-8-11(14)15/h2-4,7,11H,5-6,8H2,1H3
InChIKey CRGPFGYURXKDME-UHFFFAOYSA-N
Mol Weight 321.16 g/mol
Molecular Formula C13H14Cl2O5
Exact Mass 320.021829 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID y5WnUsesia
Name Succinic acid, 2,2-dichloroethyl 3-methoxyphenyl ester
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 320.021828946 u
Formula C13H14Cl2O5
InChI InChI=1S/C13H14Cl2O5/c1-18-9-3-2-4-10(7-9)20-13(17)6-5-12(16)19-8-11(14)15/h2-4,7,11H,5-6,8H2,1H3
InChIKey CRGPFGYURXKDME-UHFFFAOYSA-N
Molecular Weight 321.156 g/mol
SMILES C(CC(OCC(Cl)Cl)=O)C(OC1=CC=CC(=C1)OC)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.877062