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3-(2-HYDROXY-5-METHYLPHENYL)-5-PHENYL-4,5-DIHYDRO-1H-PYRAZOLE-1-CARBOTHIOAMIDE
SpectraBase Compound ID BlKVA3TZOoz
InChI InChI=1S/C17H17N3OS/c1-11-7-8-16(21)13(9-11)14-10-15(20(19-14)17(18)22)12-5-3-2-4-6-12/h2-9,15,21H,10H2,1H3,(H2,18,22)
InChIKey YJIOBNSBXLAPGT-UHFFFAOYSA-N
Mol Weight 311.4 g/mol
Molecular Formula C17H17N3OS
Exact Mass 311.109233 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8QaWBVH0GzY
Name 3-(2-HYDROXY-5-METHYLPHENYL)-5-PHENYL-4,5-DIHYDRO-1H-PYRAZOLE-1-CARBOTHIOAMIDE
Compound Number IV
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C17H17N3OS
InChI InChI=1S/C17H17N3OS/c1-11-7-8-16(21)13(9-11)14-10-15(20(19-14)17(18)22)12-5-3-2-4-6-12/h2-9,15,21H,10H2,1H3,(H2,18,22)
InChIKey YJIOBNSBXLAPGT-UHFFFAOYSA-N
Literature Reference Author I.G.MAMEDOV,M.R.BAYRAMOV,Y.V.MAMEDOVA,A.M.MAHARRAMOV
Literature Reference Citation MAGN.RES.CHEM.,51,234(2013)
Literature Reference DOI 10.1002/mrc.3933
Molecular Weight 311.401 g/mol
Solvent DMSO-D6
Source File Reference UWIR12928