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2-Amino-3-cyano-3-(ethoxycarbonyl)-1(N)-{[N-(butoxycarbonyl)-N-[(ethoxycarbonyl)methyl]amino}-4-methylpyrrole
SpectraBase Compound ID 69bx3ePjwOs
InChI InChI=1S/C18H26N4O6/c1-7-26-13(23)10-21(17(25)28-18(4,5)6)22-11(3)14(16(24)27-8-2)12(9-19)15(22)20/h7-8,10,20H2,1-6H3
InChIKey MKMWWEIAFIZRSA-UHFFFAOYSA-N
Mol Weight 394.43 g/mol
Molecular Formula C18H26N4O6
Exact Mass 394.185235 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JHbIVqzp2ba
Name 2-Amino-3-cyano-3-(ethoxycarbonyl)-1(N)-{[N-(butoxycarbonyl)-N-[(ethoxycarbonyl)methyl]amino}-4-methylpyrrole
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H26N4O6
InChI InChI=1S/C18H26N4O6/c1-7-26-13(23)10-21(17(25)28-18(4,5)6)22-11(3)14(16(24)27-8-2)12(9-19)15(22)20/h7-8,10,20H2,1-6H3
InChIKey MKMWWEIAFIZRSA-UHFFFAOYSA-N
Molecular Weight 394.428 g/mol
SMILES Nc1[n](N(C(OC(C)(C)C)=O)CC(=O)OCC)c(c(c1C#N)C(=O)OCC)C
SPLASH splash10-000f-0639000000-be5d91e2c85524dd3382
Source of Spectrum D1-2006-1737-13
Wiley ID 1614104