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4-BENZYL-5-BENZYLAMINO-3-METHYLTHIO-4H-1,2,4-TRIAZOLE

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4-BENZYL-5-BENZYLAMINO-3-METHYLTHIO-4H-1,2,4-TRIAZOLE
SpectraBase Compound ID 2jEpxb56k7b
InChI InChI=1S/C17H18N4S/c1-22-17-20-19-16(18-12-14-8-4-2-5-9-14)21(17)13-15-10-6-3-7-11-15/h2-11H,12-13H2,1H3,(H,18,19)
InChIKey CSLXJWPXSBWZCV-UHFFFAOYSA-N
Mol Weight 310.42 g/mol
Molecular Formula C17H18N4S
Exact Mass 310.125218 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LIlUpMaao9L
Name 4-BENZYL-5-BENZYLAMINO-3-METHYLTHIO-4H-1,2,4-TRIAZOLE
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C17H18N4S
InChI InChI=1S/C17H18N4S/c1-22-17-20-19-16(18-12-14-8-4-2-5-9-14)21(17)13-15-10-6-3-7-11-15/h2-11H,12-13H2,1H3,(H,18,19)
InChIKey CSLXJWPXSBWZCV-UHFFFAOYSA-N
Literature Reference Author J.REITER,L.PONGO,P.DVORTSAK
Literature Reference Citation J.HETCYCL.CHEM.,24,127(1987)
Literature Reference DOI 10.1002/jhet.5570240126
Molecular Weight 310.417 g/mol
Solvent DMSO-D6
Source File Reference UWCS7849