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2-(5-AMINO-3-METHYLTHIO-1H-1,2,4-TRIAZOL-1-YL)-5-ETHYLAMINO-1,3,4-THIADIAZOLE
SpectraBase Compound ID 4uJNNWByfO4
InChI InChI=1S/C7H11N7S2/c1-3-9-5-11-12-7(16-5)14-4(8)10-6(13-14)15-2/h3H2,1-2H3,(H,9,11)(H2,8,10,13)
InChIKey KVXWQPFZGVAARW-UHFFFAOYSA-N
Mol Weight 257.33 g/mol
Molecular Formula C7H11N7S2
Exact Mass 257.051736 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8rkaSIkHxPP
Name 2-(5-AMINO-3-METHYLTHIO-1H-1,2,4-TRIAZOL-1-YL)-5-ETHYLAMINO-1,3,4-THIADIAZOLE
Compound Number 16
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C7H11N7S2
InChI InChI=1S/C7H11N7S2/c1-3-9-5-11-12-7(16-5)14-4(8)10-6(13-14)15-2/h3H2,1-2H3,(H,9,11)(H2,8,10,13)
InChIKey KVXWQPFZGVAARW-UHFFFAOYSA-N
Literature Reference Author J.REITER,J.BARKOCZY
Literature Reference Citation J.HETCYCL.CHEM.,30,333(1993)
Literature Reference DOI 10.1002/jhet.5570300207
Molecular Weight 257.331 g/mol
Solvent DMSO-D6
Source File Reference UWPB260