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3-(1-HYDROXY-NAPHTHALEN-2-YL)-5-(2-METHOXYPHENYL)-N-PHENYL-PYRAZOLINE-1-CARBOTHIOAMIDE
SpectraBase Compound ID I3IEFGU9WFd
InChI InChI=1S/C27H23N3O2S/c1-32-25-14-8-7-13-22(25)24-17-23(21-16-15-18-9-5-6-12-20(18)26(21)31)29-30(24)27(33)28-19-10-3-2-4-11-19/h2-16,24,31H,17H2,1H3,(H,28,33)
InChIKey KGNPTRQOBDTUNV-UHFFFAOYSA-N
Mol Weight 453.56 g/mol
Molecular Formula C27H23N3O2S
Exact Mass 453.151098 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6HRBHL3B9LR
Name 3-(1-HYDROXY-NAPHTHALEN-2-YL)-5-(2-METHOXYPHENYL)-N-PHENYL-PYRAZOLINE-1-CARBOTHIOAMIDE
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C27H23N3O2S
InChI InChI=1S/C27H23N3O2S/c1-32-25-14-8-7-13-22(25)24-17-23(21-16-15-18-9-5-6-12-20(18)26(21)31)29-30(24)27(33)28-19-10-3-2-4-11-19/h2-16,24,31H,17H2,1H3,(H,28,33)
InChIKey KGNPTRQOBDTUNV-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 453.559 g/mol
Solvent DMSO-D6
Source File Reference UWIR13417