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BARIUM-2-METHYL-5-NITRIMINOTETRAZOLATE-DIHYDRATE
SpectraBase Compound ID KCy3MeZDgVz
InChI InChI=1S/2C2H3N6O2.Ba.2H2O/c2*1-7-4-2(3-6-7)5-8(9)10;;;/h2*1H3;;2*1H2/q2*-1;+2;;
InChIKey WOMHTOBUNRVDAD-UHFFFAOYSA-N
Mol Weight 459.53 g/mol
Molecular Formula C4H10BaN12O6
Exact Mass 459.989873 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8vpzd6D7eci
Name BARIUM-2-METHYL-5-NITRIMINOTETRAZOLATE-DIHYDRATE
Compound Number 11
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C4H10BaN12O6
InChI InChI=1S/2C2H3N6O2.Ba.2H2O/c2*1-7-4-2(3-6-7)5-8(9)10;;;/h2*1H3;;2*1H2/q2*-1;+2;;
InChIKey WOMHTOBUNRVDAD-UHFFFAOYSA-N
Literature Reference Author R.DAMAVARAPU,T.M.KLAPOETKE,J.STIERSTORFER,K.R.TARANTIK
Literature Reference Citation PROP.EXPL.PYROT.,35,395(2010)
Literature Reference DOI 10.1002/prep.200900058
Molecular Weight 459.530 g/mol
Solvent DMSO-D6
Source File Reference UWLU78398