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5-(4,6-DIMETHYL-2-PYRIMIDINYL)-2-(PHENYLCARBONYLMETHYLTHIO)-1,3,4-OXADIAZOLE
SpectraBase Compound ID IxMJcq6QOgG
InChI InChI=1S/C16H14N4O2S/c1-10-8-11(2)18-14(17-10)15-19-20-16(22-15)23-9-13(21)12-6-4-3-5-7-12/h3-8H,9H2,1-2H3
InChIKey OIRFAOHFNZFCSF-UHFFFAOYSA-N
Mol Weight 326.37 g/mol
Molecular Formula C16H14N4O2S
Exact Mass 326.083747 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID E2hWk9EDkyr
Name 5-(4,6-DIMETHYL-2-PYRIMIDINYL)-2-(PHENYLCARBONYLMETHYLTHIO)-1,3,4-OXADIAZOLE
Compound Number III-D
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C16H14N4O2S
InChI InChI=1S/C16H14N4O2S/c1-10-8-11(2)18-14(17-10)15-19-20-16(22-15)23-9-13(21)12-6-4-3-5-7-12/h3-8H,9H2,1-2H3
InChIKey OIRFAOHFNZFCSF-UHFFFAOYSA-N
Literature Reference Author G.MEKUSKIENE,P.VAINILAVICIUS,A.HETZHEIM,R.SHEMATOVICH
Literature Reference Citation CHEM.HET.COMP.,29,598(1993)
Literature Reference DOI 10.1007/bf00534477
Molecular Weight 326.373 g/mol
Solvent CDCl3
Source File Reference UWMZ12563