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Pentanedioic acid, 2,4-diacetyl-3-methyl-, diethyl ester

View entire compound with spectra: 1 FTIR

Pentanedioic acid, 2,4-diacetyl-3-methyl-, diethyl ester
SpectraBase Compound ID 9xwoTHhcWTE
InChI InChI=1S/C14H22O6/c1-6-19-13(17)11(9(4)15)8(3)12(10(5)16)14(18)20-7-2/h8,11-12H,6-7H2,1-5H3
InChIKey QRDRBGYJAXEENQ-UHFFFAOYSA-N
Mol Weight 286.32 g/mol
Molecular Formula C14H22O6
Exact Mass 286.141638 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 8xjcz2SLjbg
Name Pentanedioic acid, 2,4-diacetyl-3-methyl-, diethyl ester
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 286.141638422 u
Formula C14H22O6
InChI InChI=1S/C14H22O6/c1-6-19-13(17)11(9(4)15)8(3)12(10(5)16)14(18)20-7-2/h8,11-12H,6-7H2,1-5H3
InChIKey QRDRBGYJAXEENQ-UHFFFAOYSA-N
SMILES C(OC(C(C(C(C(OCC)=O)C(=O)C)C)C(=O)C)=O)C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.991888