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KTLAKOMTSNRDCS-UHFFFAOYSA-N
SpectraBase Compound ID 2RyFw8vxJ0s
InChI InChI=1S/C16H15N3S2/c1-20-13-7-3-11(4-8-13)15-17-16(19-18-15)12-5-9-14(21-2)10-6-12/h3-10H,1-2H3,(H,17,18,19)
InChIKey KTLAKOMTSNRDCS-UHFFFAOYSA-N
Mol Weight 313.44 g/mol
Molecular Formula C16H15N3S2
Exact Mass 313.07074 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID SzpNWDuB6e
Name 3,5-DI-(4'-METHYLTHIOPHENYL)-4H-1,2,4-TRIAZOLE
Compound Number 2I
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C16H15N3S2
InChI InChI=1S/C16H15N3S2/c1-20-13-7-3-11(4-8-13)15-17-16(19-18-15)12-5-9-14(21-2)10-6-12/h3-10H,1-2H3,(H,17,18,19)
InChIKey KTLAKOMTSNRDCS-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 313.435 g/mol
Solvent DMSO-D6
Source File Reference UWSI8504