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

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5-ACETYLAMINO-4-BENZYL-3-METHYLTHIO-4H-1,2,4-TRIAZOLE
SpectraBase Compound ID 732tAHxbyTg
InChI InChI=1S/C12H14N4OS/c1-9(17)13-11-14-15-12(18-2)16(11)8-10-6-4-3-5-7-10/h3-7H,8H2,1-2H3,(H,13,14,17)
InChIKey WWYHSJBHIQTFMK-UHFFFAOYSA-N
Mol Weight 262.33 g/mol
Molecular Formula C12H14N4OS
Exact Mass 262.088832 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7yGYQXxJ585
Name 5-ACETYLAMINO-4-BENZYL-3-METHYLTHIO-4H-1,2,4-TRIAZOLE
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H14N4OS
InChI InChI=1S/C12H14N4OS/c1-9(17)13-11-14-15-12(18-2)16(11)8-10-6-4-3-5-7-10/h3-7H,8H2,1-2H3,(H,13,14,17)
InChIKey WWYHSJBHIQTFMK-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 262.329 g/mol
Solvent DMSO-D6
Source File Reference UWCS7855