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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

15N Nuclear Magnetic Resonance (NMR) Chemical Shifts

15N Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LxUVNRGkUE1
Name 1-BENZYL-2-AMINO-5-METHYLTHIO-1,3,4-TRIAZOLE
Compound Number 230
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 R.M.CLARAMUNT,D.SANZ,C.LOPEZ,J.A.JIMENEZ,M.L.JIMENO,J.ELGUER O,A.FRUCHIER
Literature Reference Citation MAGN.RES.CHEM.,35,35(1997)
Literature Reference DOI 10.1002/(sici)1097-458x(199701)35:1<35::aid-omr25>3.0.co;2-k
Solvent DMSO
Source File Reference UWKP1347