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Diethyl 2-cyano-3-(morpholin-4'-yl)but-2-ene-1,4-dioate

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

Diethyl 2-cyano-3-(morpholin-4'-yl)but-2-ene-1,4-dioate
SpectraBase Compound ID KS52hiJ8b95
InChI InChI=1S/C13H18N2O5/c1-3-19-12(16)10(9-14)11(13(17)20-4-2)15-5-7-18-8-6-15/h3-8H2,1-2H3/b11-10+
InChIKey RMBIEWYSBISUEU-ZHACJKMWSA-N
Mol Weight 282.3 g/mol
Molecular Formula C13H18N2O5
Exact Mass 282.121572 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 3aYCeEOALVq
Name Diethyl 2-cyano-3-(morpholin-4'-yl)but-2-ene-1,4-dioate
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 282.121571683 u
Formula C13H18N2O5
InChI InChI=1S/C13H18N2O5/c1-3-19-12(16)10(9-14)11(13(17)20-4-2)15-5-7-18-8-6-15/h3-8H2,1-2H3/b11-10+
InChIKey RMBIEWYSBISUEU-ZHACJKMWSA-N
SMILES C1N(\C(=C\(C(=O)OCC)C#N)C(=O)OCC)CCOC1
Spectrum/Structure Validation Score (Vapor Phase IR) 0.872769