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3,5-dimethyl-1-phenyl-4-{[alpha-(phenylthio)benzyl]trio}pyrazole
SpectraBase Compound ID 3Iz6u5UMAzq
InChI InChI=1S/C24H22N2S2/c1-18-23(19(2)26(25-18)21-14-8-4-9-15-21)28-24(20-12-6-3-7-13-20)27-22-16-10-5-11-17-22/h3-17,24H,1-2H3
InChIKey PKNKVGXBYCINFU-UHFFFAOYSA-N
Mol Weight 402.57 g/mol
Molecular Formula C24H22N2S2
Exact Mass 402.122441 g/mol

1H Nuclear Magnetic Resonance (NMR) Chemical Shifts

1H Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DaQZgzRGmEG
Name 3,5-dimethyl-1-phenyl-4-{[alpha-(phenylthio)benzyl]trio}pyrazole
Copyright Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H22N2S2
InChI InChI=1S/C24H22N2S2/c1-18-23(19(2)26(25-18)21-14-8-4-9-15-21)28-24(20-12-6-3-7-13-20)27-22-16-10-5-11-17-22/h3-17,24H,1-2H3
InChIKey PKNKVGXBYCINFU-UHFFFAOYSA-N
Instrument Name Varian CFT-20
Sadtler NMR Number 26147M
Solvent CDCl3