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#6C;METHYL-3-(4',5'-DIHYDRO-1'-PHENYL-3'-(PARA-CHLOROPHENYL)-5'-(PARA-METHYLPHENYL)-PYRAZOL-4'-YLSULFONYL)-4-(PARA-CHLOROPHENYL)-3H-PYRROLE-3-CARBOXYLATE
SpectraBase Compound ID PywNa8dNJx
InChI InChI=1S/C34H27Cl2N3O4S/c1-22-8-10-25(11-9-22)31-32(30(24-14-18-27(36)19-15-24)38-39(31)28-6-4-3-5-7-28)44(41,42)34(33(40)43-2)21-37-20-29(34)23-12-16-26(35)17-13-23/h3-21,31-32H,1-2H3
InChIKey RKVMGFQWWKZXQF-UHFFFAOYSA-N
Mol Weight 644.6 g/mol
Molecular Formula C34H27Cl2N3O4S
Exact Mass 643.109933 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID IJeeuLIj7Vn
Name #6C;METHYL-3-(4',5'-DIHYDRO-1'-PHENYL-3'-(PARA-CHLOROPHENYL)-5'-(PARA-METHYLPHENYL)-PYRAZOL-4'-YLSULFONYL)-4-(PARA-CHLOROPHENYL)-3H-PYRROLE-3-CARBOXYLATE
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C34H27Cl2N3O4S
InChI InChI=1S/C34H27Cl2N3O4S/c1-22-8-10-25(11-9-22)31-32(30(24-14-18-27(36)19-15-24)38-39(31)28-6-4-3-5-7-28)44(41,42)34(33(40)43-2)21-37-20-29(34)23-12-16-26(35)17-13-23/h3-21,31-32H,1-2H3
InChIKey RKVMGFQWWKZXQF-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 644.572 g/mol
Sample ID 3149
Solvent DMSO-D6