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

View entire compound with spectra: 2 NMR

5-Amino-3-methylthio-2-piperonyl-1,2,4-triazole
SpectraBase Compound ID DGIgJqGFveX
InChI InChI=1S/C11H12N4O2S/c1-18-11-13-10(12)14-15(11)5-7-2-3-8-9(4-7)17-6-16-8/h2-4H,5-6H2,1H3,(H2,12,14)
InChIKey IBNKNUOABVXOTK-UHFFFAOYSA-N
Mol Weight 264.3 g/mol
Molecular Formula C11H12N4O2S
Exact Mass 264.068097 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID IbWuFBtA3QF
Name 5-AMINO-3-METHYLTHIO-2-PIPERONYL-1,2,4-TRIAZOLE
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C11H12N4O2S
InChI InChI=1S/C11H12N4O2S/c1-18-11-13-10(12)14-15(11)5-7-2-3-8-9(4-7)17-6-16-8/h2-4H,5-6H2,1H3,(H2,12,14)
InChIKey IBNKNUOABVXOTK-UHFFFAOYSA-N
Literature Reference Author P.DVORTSAK,J.REITER,T.SOMORAI,P.SOHAR
Literature Reference Citation MAGN.RES.CHEM.,23,194(1985)
Literature Reference DOI 10.1002/mrc.1260230313
Molecular Weight 264.302 g/mol
Solvent DMSO
Source File Reference UNIW12204