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5,7-DINITROBENZO-1,2,3,4-TETRAZINE-1,3-DIOXIDE;DNBTDO
SpectraBase Compound ID Bq0Zk6vf0Of
InChI InChI=1S/C6H2N6O6/c13-9-4-1-3(10(14)15)2-5(11(16)17)6(4)7-12(18)8-9/h1-2H
InChIKey BCTCWTNTQNGYDM-UHFFFAOYSA-N
Mol Weight 254.12 g/mol
Molecular Formula C6H2N6O6
Exact Mass 254.003582 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID IJPdYpjWB3e
Name 5,7-DINITROBENZO-1,2,3,4-TETRAZINE-1,3-DIOXIDE;DNBTDO
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C6H2N6O6
InChI InChI=1S/C6H2N6O6/c13-9-4-1-3(10(14)15)2-5(11(16)17)6(4)7-12(18)8-9/h1-2H
InChIKey BCTCWTNTQNGYDM-UHFFFAOYSA-N
Literature Reference Author T.M.KLAPOETKE,D.G.PIERCEY,J.STIERSTORFER,M.WEYRAUTHER
Literature Reference Citation PROP.EXPL.PYROT.,37,527(2012)
Literature Reference DOI 10.1002/prep.201100151
Molecular Weight 254.118 g/mol
Solvent ACETONE-D6
Source File Reference UWLU78349