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METHYL-3-[4'-(PARA-METHYLPHENYL)-1'H-PYRROL-3'-YLSULFONYL]-4-(PARA-CHLOROPHENYL)-3H-PYRROLE-3-CARBOXYLATE
SpectraBase Compound ID 8m2OXjWmBL6
InChI InChI=1S/C23H19ClN2O4S/c1-15-3-5-16(6-4-15)19-11-25-13-21(19)31(28,29)23(22(27)30-2)14-26-12-20(23)17-7-9-18(24)10-8-17/h3-14,25H,1-2H3
InChIKey UCSMIZCGNDMKTO-UHFFFAOYSA-N
Mol Weight 454.93 g/mol
Molecular Formula C23H19ClN2O4S
Exact Mass 454.075406 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3JiW2BkGExf
Name METHYL-3-[4'-(PARA-METHYLPHENYL)-1'H-PYRROL-3'-YLSULFONYL]-4-(PARA-CHLOROPHENYL)-3H-PYRROLE-3-CARBOXYLATE
Compound Number 3C
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C23H19ClN2O4S
InChI InChI=1S/C23H19ClN2O4S/c1-15-3-5-16(6-4-15)19-11-25-13-21(19)31(28,29)23(22(27)30-2)14-26-12-20(23)17-7-9-18(24)10-8-17/h3-14,25H,1-2H3
InChIKey UCSMIZCGNDMKTO-UHFFFAOYSA-N
Literature Reference Author V.PADMAVATHI,T.R.LAKSHMI,K.MAHESH,A.PADMAJA
Literature Reference Citation CHEM.PHARM.BULL.,57,1200(2009)
Literature Reference DOI 10.1248/cpb.57.1200
Molecular Weight 454.928 g/mol
Sample ID 3140
Solvent DMSO-D6