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3,5-DI-(2'-METHYLPHENYL)-4H-1,2,4-TRIAZOLE

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3,5-DI-(2'-METHYLPHENYL)-4H-1,2,4-TRIAZOLE
SpectraBase Compound ID JJZIcf09Kis
InChI InChI=1S/C16H15N3/c1-11-7-3-5-9-13(11)15-17-16(19-18-15)14-10-6-4-8-12(14)2/h3-10H,1-2H3,(H,17,18,19)
InChIKey CJJLZZUJURYVAA-UHFFFAOYSA-N
Mol Weight 249.32 g/mol
Molecular Formula C16H15N3
Exact Mass 249.126597 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9KIm16oosN4
Name 3,5-DI-(2'-METHYLPHENYL)-4H-1,2,4-TRIAZOLE
Compound Number 2B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C16H15N3
InChI InChI=1S/C16H15N3/c1-11-7-3-5-9-13(11)15-17-16(19-18-15)14-10-6-4-8-12(14)2/h3-10H,1-2H3,(H,17,18,19)
InChIKey CJJLZZUJURYVAA-UHFFFAOYSA-N
Literature Reference Author F.BENTISS,M.LAGRENEE,H.VEZIN,M.BOUANIS,B.MERNARI
Literature Reference Citation J.HETCYCL.CHEM.,39,93(2002)
Literature Reference DOI 10.1002/jhet.5570390113
Molecular Weight 249.315 g/mol
Solvent DMSO-D6
Source File Reference UWSI8497