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Diethyl 2-[(t-butylamino)carbonyl]-3-{[(4'-methylphenyl)amino]carbonyl}-2-butenedioate
SpectraBase Compound ID Dvqn7DkyXOI
InChI InChI=1S/C21H28N2O6/c1-7-28-19(26)15(17(24)22-14-11-9-13(3)10-12-14)16(20(27)29-8-2)18(25)23-21(4,5)6/h9-12H,7-8H2,1-6H3,(H,22,24)(H,23,25)/b16-15+
InChIKey WNEMNVGETWDPSV-FOCLMDBBSA-N
Mol Weight 404.46 g/mol
Molecular Formula C21H28N2O6
Exact Mass 404.194737 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KmXVZXTTa7L
Name Diethyl 2-[(t-butylamino)carbonyl]-3-{[(4'-methylphenyl)amino]carbonyl}-2-butenedioate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H28N2O6
InChI InChI=1S/C21H28N2O6/c1-7-28-19(26)15(17(24)22-14-11-9-13(3)10-12-14)16(20(27)29-8-2)18(25)23-21(4,5)6/h9-12H,7-8H2,1-6H3,(H,22,24)(H,23,25)/b16-15+
InChIKey WNEMNVGETWDPSV-FOCLMDBBSA-N
Molecular Weight 404.463 g/mol
SMILES N(C(\C(=C\(C(NC(C)(C)C)=O)C(=O)OCC)C(=O)OCC)=O)c1ccc(cc1)C
SPLASH splash10-0a4i-5943000000-a6039f2e97bdd6e5835d
Source of Spectrum AH-139-52-3d
Wiley ID 1696012