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3-NITRO-1,2,4-TRIAZOLIN-5-ONE
SpectraBase Compound ID 5wCaXbRdZ76
InChI InChI=1S/C2H2N4O3/c7-2-3-1(4-5-2)6(8)9/h(H2,3,4,5,7)
InChIKey QJTIRVUEVSKJTK-UHFFFAOYSA-N
Mol Weight 130.06 g/mol
Molecular Formula C2H2N4O3
Exact Mass 130.01269 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9cOkp1GMcps
Name 3-NITRO-1,2,4-TRIAZOL-5-ONE;NTO
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C2H2N4O3
InChI InChI=1S/C2H2N4O3/c7-2-3-1(4-5-2)6(8)9/h(H2,3,4,5,7)
InChIKey QJTIRVUEVSKJTK-UHFFFAOYSA-N
Literature Reference Author J.H.YI,F.Q.ZHAO,H.X.GAO,S.Y.XU,M.C.WANG,R.Z.HU
Literature Reference Citation J.HAZARD.MAT.,153,261(2008)
Literature Reference DOI 10.1016/j.jhazmat.2007.08.064
Molecular Weight 130.063 g/mol
Solvent DMSO-D6
Source File Reference UWLU78571