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Adipic acid, di(2,2-dichloroethyl) ester

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Adipic acid, di(2,2-dichloroethyl) ester
SpectraBase Compound ID r37n3WQlMK
InChI InChI=1S/C10H14Cl4O4/c11-7(12)5-17-9(15)3-1-2-4-10(16)18-6-8(13)14/h7-8H,1-6H2
InChIKey ZJYPQKZQJGCLAZ-UHFFFAOYSA-N
Mol Weight 340.0 g/mol
Molecular Formula C10H14Cl4O4
Exact Mass 337.96462 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 3EAlHpFRNMA
Name Adipic acid, di(2,2-dichloroethyl) ester
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 337.964619727 u
Formula C10H14Cl4O4
InChI InChI=1S/C10H14Cl4O4/c11-7(12)5-17-9(15)3-1-2-4-10(16)18-6-8(13)14/h7-8H,1-6H2
InChIKey ZJYPQKZQJGCLAZ-UHFFFAOYSA-N
Molecular Weight 340.030 g/mol
SMILES C(C(OCC(Cl)Cl)=O)CCCC(OCC(Cl)Cl)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.948827