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4-(4-METHYLPHENYL)-3-(4-PYRIDYL)-1,2,4-OXADIAZOLE-5(4H)-THIONE

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4-(4-METHYLPHENYL)-3-(4-PYRIDYL)-1,2,4-OXADIAZOLE-5(4H)-THIONE
SpectraBase Compound ID KZHnFN7H1P9
InChI InChI=1S/C14H11N3OS/c1-10-2-4-12(5-3-10)17-13(16-18-14(17)19)11-6-8-15-9-7-11/h2-9H,1H3
InChIKey OUCSLWXFSBQXHE-UHFFFAOYSA-N
Mol Weight 269.32 g/mol
Molecular Formula C14H11N3OS
Exact Mass 269.062283 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID H9FUWKUeVvj
Name 4-(4-METHYLPHENYL)-3-(4-PYRIDYL)-1,2,4-OXADIAZOLE-5(4H)-THIONE
Compound Number 2G
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C14H11N3OS
InChI InChI=1S/C14H11N3OS/c1-10-2-4-12(5-3-10)17-13(16-18-14(17)19)11-6-8-15-9-7-11/h2-9H,1H3
InChIKey OUCSLWXFSBQXHE-UHFFFAOYSA-N
Literature Reference Author Y.DUERUEST
Literature Reference Citation MAGN.RES.CHEM.,36,878(1998)
Literature Reference DOI 10.1002/(sici)1097-458x(1998110)36:11<878::aid-omr373>3.3.co;2-u
Molecular Weight 269.321 g/mol
Solvent CDCl3
Source File Reference UWCS24741