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3-Ethoxycarbonyl-2,5-dimethyl-4-diethylaminocarbonyl-1-(N'-phenyl-ureido)-pyrrole
SpectraBase Compound ID 4QViMOXRVme
InChI InChI=1S/C21H28N4O4/c1-6-24(7-2)19(26)17-14(4)25(15(5)18(17)20(27)29-8-3)23-21(28)22-16-12-10-9-11-13-16/h9-13H,6-8H2,1-5H3,(H2,22,23,28)
InChIKey NYJAMOFEWPBFSN-UHFFFAOYSA-N
Mol Weight 400.48 g/mol
Molecular Formula C21H28N4O4
Exact Mass 400.211055 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Dwh9mQ3c93G
Name 3-Ethoxycarbonyl-2,5-dimethyl-4-diethylaminocarbonyl-1-(N'-phenyl-ureido)-pyrrole
CAS Registry Number 94126-68-8
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C21H28N4O4
InChI InChI=1S/C21H28N4O4/c1-6-24(7-2)19(26)17-14(4)25(15(5)18(17)20(27)29-8-3)23-21(28)22-16-12-10-9-11-13-16/h9-13H,6-8H2,1-5H3,(H2,22,23,28)
InChIKey NYJAMOFEWPBFSN-UHFFFAOYSA-N
Instrument Name Bruker CXP-300
Literature Reference O.A. Attanasi, M. Grossi, F.R. Perrulli, Magn. Res. Chem. 26, 714 (1988).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3