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3-(1-HYDROXY-NAPHTHALEN-2-YL)-5-(2-METHOXYPHENYL)-N-(3-METHOXYPHENYL)-PYRAZOLINE-1-CARBOTHIOAMIDE
SpectraBase Compound ID J3DXfs4jjXM
InChI InChI=1S/C28H25N3O3S/c1-33-20-10-7-9-19(16-20)29-28(35)31-25(23-12-5-6-13-26(23)34-2)17-24(30-31)22-15-14-18-8-3-4-11-21(18)27(22)32/h3-16,25,32H,17H2,1-2H3,(H,29,35)
InChIKey CDLOQMXOKWBPPT-UHFFFAOYSA-N
Mol Weight 483.59 g/mol
Molecular Formula C28H25N3O3S
Exact Mass 483.161663 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID AfwGveQ9HZe
Name 3-(1-HYDROXY-NAPHTHALEN-2-YL)-5-(2-METHOXYPHENYL)-N-(3-METHOXYPHENYL)-PYRAZOLINE-1-CARBOTHIOAMIDE
Compound Number 3
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C28H25N3O3S
InChI InChI=1S/C28H25N3O3S/c1-33-20-10-7-9-19(16-20)29-28(35)31-25(23-12-5-6-13-26(23)34-2)17-24(30-31)22-15-14-18-8-3-4-11-21(18)27(22)32/h3-16,25,32H,17H2,1-2H3,(H,29,35)
InChIKey CDLOQMXOKWBPPT-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 483.585 g/mol
Solvent DMSO-D6
Source File Reference UWIR13419