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5-Amino-4-benzyl-3-methylthio-1,2,4-triazole

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5-Amino-4-benzyl-3-methylthio-1,2,4-triazole
SpectraBase Compound ID KBD4ROx78Kg
InChI InChI=1S/C10H12N4S/c1-15-10-13-12-9(11)14(10)7-8-5-3-2-4-6-8/h2-6H,7H2,1H3,(H2,11,12)
InChIKey INKJDQIQHAAPSX-UHFFFAOYSA-N
Mol Weight 220.29 g/mol
Molecular Formula C10H12N4S
Exact Mass 220.078268 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8WTXvyR4Lnf
Name INKJDQIQHAAPSX-UHFFFAOYSA-N
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C10H12N4S
InChI InChI=1S/C10H12N4S/c1-15-10-13-12-9(11)14(10)7-8-5-3-2-4-6-8/h2-6H,7H2,1H3,(H2,11,12)
InChIKey INKJDQIQHAAPSX-UHFFFAOYSA-N
Literature Reference Author ORGANIC_CHEMISTRY_(NMR-DEPARTMENT);UNIVERSITY_MAINZ
Literature Reference Citation UNI_MAINZ,INTERNAL_DB(2007)
Molecular Weight 220.292 g/mol
Source File Reference MHKO22248