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4-(4-Chloro-phenyl)carbamoyl-3-methoxycarbonyl-2,5-dimethyl-1-tosylamino-pyrrole
SpectraBase Compound ID 4re3zwnviSn
InChI InChI=1S/C22H22ClN3O5S/c1-13-5-11-18(12-6-13)32(29,30)25-26-14(2)19(20(15(26)3)22(28)31-4)21(27)24-17-9-7-16(23)8-10-17/h5-12,25H,1-4H3,(H,24,27)
InChIKey CTLXXPJZIBRNCJ-UHFFFAOYSA-N
Mol Weight 475.95 g/mol
Molecular Formula C22H22ClN3O5S
Exact Mass 475.09687 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID AqgLNvsCCnp
Name 4-(4-Chloro-phenyl)carbamoyl-3-methoxycarbonyl-2,5-dimethyl-1-tosylamino-pyrrole
CAS Registry Number 95239-21-7
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C22H22ClN3O5S
InChI InChI=1S/C22H22ClN3O5S/c1-13-5-11-18(12-6-13)32(29,30)25-26-14(2)19(20(15(26)3)22(28)31-4)21(27)24-17-9-7-16(23)8-10-17/h5-12,25H,1-4H3,(H,24,27)
InChIKey CTLXXPJZIBRNCJ-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