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Diethyl (1,2,2-trimethylpropyl)malenate

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

Diethyl (1,2,2-trimethylpropyl)malenate
SpectraBase Compound ID 5ph4PviWwcl
InChI InChI=1S/C13H24O4/c1-7-16-11(14)10(12(15)17-8-2)9(3)13(4,5)6/h9-10H,7-8H2,1-6H3
InChIKey JJQYQNVVRRCZPT-UHFFFAOYSA-N
Mol Weight 244.33 g/mol
Molecular Formula C13H24O4
Exact Mass 244.167459 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 7LcJnwGZrsd
Name Diethyl (1,2,2-trimethylpropyl)malenate
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 244.167459249 u
Formula C13H24O4
InChI InChI=1S/C13H24O4/c1-7-16-11(14)10(12(15)17-8-2)9(3)13(4,5)6/h9-10H,7-8H2,1-6H3
InChIKey JJQYQNVVRRCZPT-UHFFFAOYSA-N
Molecular Weight 244.331 g/mol
SMILES C(C(=O)OCC)(C(=O)OCC)C(C(C)(C)C)C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.98631