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3,5-Diethylbenzene-1,2-dicarboxylic acid diethyl ester

View entire compound with spectra: 1 FTIR, and 1 MS (GC)

3,5-Diethylbenzene-1,2-dicarboxylic acid diethyl ester
SpectraBase Compound ID DLASQa64Ot7
InChI InChI=1S/C16H22O4/c1-5-11-9-12(6-2)14(16(18)20-8-4)13(10-11)15(17)19-7-3/h9-10H,5-8H2,1-4H3
InChIKey SDAWNGCOMIUIRW-UHFFFAOYSA-N
Mol Weight 278.35 g/mol
Molecular Formula C16H22O4
Exact Mass 278.151809 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID D5LW4LjQK2f
Name 3,5-Diethylbenzene-1,2-dicarboxylic acid diethyl ester
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 278.151809184 u
Formula C16H22O4
InChI InChI=1S/C16H22O4/c1-5-11-9-12(6-2)14(16(18)20-8-4)13(10-11)15(17)19-7-3/h9-10H,5-8H2,1-4H3
InChIKey SDAWNGCOMIUIRW-UHFFFAOYSA-N
Molecular Weight 278.348 g/mol
SMILES C(C=1C(C(=O)OCC)=C(C=C(C1)CC)CC)(=O)OCC
Spectrum/Structure Validation Score (Vapor Phase IR) 0.945299