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[3-(5-NITRO-2H-1,2,4-TRIAZOLYL)]-[3-(1,2,4-TRIAZINYL)]-AMINE
SpectraBase Compound ID oJZVvNDEYs
InChI InChI=1S/C5H4N8O2/c14-13(15)5-9-4(11-12-5)8-3-6-1-2-7-10-3/h1-2H,(H2,6,8,9,10,11,12)
InChIKey QNLYDWIWNDVMBR-UHFFFAOYSA-N
Mol Weight 208.14 g/mol
Molecular Formula C5H4N8O2
Exact Mass 208.045721 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JAwSBmtWmTY
Name [3-(5-NITRO-2H-1,2,4-TRIAZOLYL)]-[3-(1,2,4-TRIAZINYL)]-AMINE
Compound Number 3F
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C5H4N8O2
InChI InChI=1S/C5H4N8O2/c14-13(15)5-9-4(11-12-5)8-3-6-1-2-7-10-3/h1-2H,(H2,6,8,9,10,11,12)
InChIKey QNLYDWIWNDVMBR-UHFFFAOYSA-N
Literature Reference Author E.GARNIER,J.AUDOUX,E.PASQUINET,F.SUZENET,D.POULLAIN,B.LEBRET ,G.GUILLAUMET
Literature Reference Citation J.ORG.CHEM.,69,7809(2004)
Literature Reference DOI 10.1021/jo0490898
Molecular Weight 208.139 g/mol
Solvent DMSO-D6
Source File Reference UWVN22709