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5-Amino-3-methylthio-2-propyl-1,2,4-triazole
SpectraBase Compound ID GhKTJ4yF5oD
InChI InChI=1S/C6H12N4S/c1-3-4-10-6(11-2)8-5(7)9-10/h3-4H2,1-2H3,(H2,7,9)
InChIKey UNIJABCNUIQDSC-UHFFFAOYSA-N
Mol Weight 172.25 g/mol
Molecular Formula C6H12N4S
Exact Mass 172.078268 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1c8YcXp3Cz
Name 5-Amino-3-methylthio-2-propyl-1,2,4-triazole
CAS Registry Number 88722-52-5
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C6H12N4S
InChI InChI=1S/C6H12N4S/c1-3-4-10-6(11-2)8-5(7)9-10/h3-4H2,1-2H3,(H2,7,9)
InChIKey UNIJABCNUIQDSC-UHFFFAOYSA-N
Instrument Name Bruker WP-80
Literature Reference P. Dvortsak, J. Reiter, T. Somorai, P.Sohar, Magn. Res. Chem. 23, 194 (1985).
NMR Standard TMS-PRSO3 Na
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent DMSO-D6