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Butane-1,1,4,4-tetracarboxylic acid tetraethyl ester

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

Butane-1,1,4,4-tetracarboxylic acid tetraethyl ester
SpectraBase Compound ID HGswUGrlOrF
InChI InChI=1S/C16H26O8/c1-5-21-13(17)11(14(18)22-6-2)9-10-12(15(19)23-7-3)16(20)24-8-4/h11-12H,5-10H2,1-4H3
InChIKey KNTOEBNUVAIYKF-UHFFFAOYSA-N
Mol Weight 346.38 g/mol
Molecular Formula C16H26O8
Exact Mass 346.162768 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 7ijHQJKRZkc
Name Butane-1,1,4,4-tetracarboxylic acid tetraethyl ester
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 346.162767789 u
Formula C16H26O8
InChI InChI=1S/C16H26O8/c1-5-21-13(17)11(14(18)22-6-2)9-10-12(15(19)23-7-3)16(20)24-8-4/h11-12H,5-10H2,1-4H3
InChIKey KNTOEBNUVAIYKF-UHFFFAOYSA-N
Molecular Weight 346.376 g/mol
SMILES C(C(=O)OCC)(C(=O)OCC)CCC(C(=O)OCC)C(=O)OCC
Spectrum/Structure Validation Score (Vapor Phase IR) 0.934977