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(S,S)-4-AMINO-3,5-BIS-(1-CHLOROETHYL)-1,2,4-TRIAZOLE
SpectraBase Compound ID BxZoGuX5cZD
InChI InChI=1S/C6H10Cl2N4/c1-3(7)5-10-11-6(4(2)8)12(5)9/h3-4H,9H2,1-2H3
InChIKey CRPUOGLWRGKJDK-UHFFFAOYSA-N
Mol Weight 209.08 g/mol
Molecular Formula C6H10Cl2N4
Exact Mass 208.028252 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GpiuEpwTv6T
Name (S,S)-4-AMINO-3,5-BIS-(1-CHLOROETHYL)-1,2,4-TRIAZOLE
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C6H10Cl2N4
InChI InChI=1S/C6H10Cl2N4/c1-3(7)5-10-11-6(4(2)8)12(5)9/h3-4H,9H2,1-2H3
InChIKey CRPUOGLWRGKJDK-UHFFFAOYSA-N
Literature Reference Author J.M.ALONSO,M.R.MARTIN,J.DEMENDOZA,T.TORRES
Literature Reference Citation HETEROCYCLES,26,989(1987)
Literature Reference DOI 10.3987/R-1987-04-0989
Molecular Weight 209.078 g/mol
Solvent DMSO-D6
Source File Reference UWED4716