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N-(2,4-DIMETHOXYPHENYL)-3-(1-HYDROXY-NAPHTHALEN-2-YL)-5-(2-METHOXYPHENYL)-PYRAZOLINE-1-CARBOTHIOAMIDE
SpectraBase Compound ID GlkoASPWlpS
InChI InChI=1S/C29H27N3O4S/c1-34-19-13-15-23(27(16-19)36-3)30-29(37)32-25(22-10-6-7-11-26(22)35-2)17-24(31-32)21-14-12-18-8-4-5-9-20(18)28(21)33/h4-16,25,33H,17H2,1-3H3,(H,30,37)
InChIKey ROXYZDSPNQBKEM-UHFFFAOYSA-N
Mol Weight 513.61 g/mol
Molecular Formula C29H27N3O4S
Exact Mass 513.172228 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JtKrpZW34fX
Name N-(2,4-DIMETHOXYPHENYL)-3-(1-HYDROXY-NAPHTHALEN-2-YL)-5-(2-METHOXYPHENYL)-PYRAZOLINE-1-CARBOTHIOAMIDE
Compound Number 5
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C29H27N3O4S
InChI InChI=1S/C29H27N3O4S/c1-34-19-13-15-23(27(16-19)36-3)30-29(37)32-25(22-10-6-7-11-26(22)35-2)17-24(31-32)21-14-12-18-8-4-5-9-20(18)28(21)33/h4-16,25,33H,17H2,1-3H3,(H,30,37)
InChIKey ROXYZDSPNQBKEM-UHFFFAOYSA-N
Literature Reference Author H.YOON,S.AHN,M.PARK,D.W.KIM,S.H.KIM,D.KOH,Y.LIM
Literature Reference Citation MAGN.RES.CHEM.,51,500(2013)
Literature Reference DOI 10.1002/mrc.3971
Molecular Weight 513.611 g/mol
Solvent DMSO-D6
Source File Reference UWIR13421