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5-(3-BROMOPHENYL)-3-(2-THIENYL)-1-METHYL-1H-1,2,4-TRIAZOLE
SpectraBase Compound ID DPkkci0NvG
InChI InChI=1S/C13H10BrN3S/c1-17-13(9-4-2-5-10(14)8-9)15-12(16-17)11-6-3-7-18-11/h2-8H,1H3
InChIKey PQUSROGAWUUQGV-UHFFFAOYSA-N
Mol Weight 320.21 g/mol
Molecular Formula C13H10BrN3S
Exact Mass 318.977882 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JgzDGLmxyFt
Name 5-(3-BROMOPHENYL)-3-(2-THIENYL)-1-METHYL-1H-1,2,4-TRIAZOLE
Compound Number 4S
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C13H10BrN3S
InChI InChI=1S/C13H10BrN3S/c1-17-13(9-4-2-5-10(14)8-9)15-12(16-17)11-6-3-7-18-11/h2-8H,1H3
InChIKey PQUSROGAWUUQGV-UHFFFAOYSA-N
Literature Reference Author M.M.EL-ABADELAH,A.Q.HUSSEIN,M.Z.NAZER,O.M.MUSA,P.RADEMACHER, H.BANDMANN
Literature Reference Citation HETEROCYCLES,36,455(1993)
Literature Reference DOI 10.3987/COM-92-6096
Molecular Weight 320.207 g/mol
Solvent CDCl3
Source File Reference UWCP6717