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4-(4-Chloro-anilino)carbonyl-3-methoxycarbonyl-2,5-dimethyl-1-ureido-pyrrole
SpectraBase Compound ID 8IQOBTqUzZ3
InChI InChI=1S/C16H17ClN4O4/c1-8-12(14(22)19-11-6-4-10(17)5-7-11)13(15(23)25-3)9(2)21(8)20-16(18)24/h4-7H,1-3H3,(H,19,22)(H3,18,20,24)
InChIKey OXPJUQYDMRKSAW-UHFFFAOYSA-N
Mol Weight 364.79 g/mol
Molecular Formula C16H17ClN4O4
Exact Mass 364.093833 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3HvorBf9sZf
Name 4-(4-Chloro-anilino)carbonyl-3-methoxycarbonyl-2,5-dimethyl-1-ureido-pyrrole
CAS Registry Number 94126-60-0
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C16H17ClN4O4
InChI InChI=1S/C16H17ClN4O4/c1-8-12(14(22)19-11-6-4-10(17)5-7-11)13(15(23)25-3)9(2)21(8)20-16(18)24/h4-7H,1-3H3,(H,19,22)(H3,18,20,24)
InChIKey OXPJUQYDMRKSAW-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