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SODIUM-5-DINITROMETHYL-1H-TETRAZOLATE-TRIHYDRATE

View entire compound with spectra: 2 NMR

SODIUM-5-DINITROMETHYL-1H-TETRAZOLATE-TRIHYDRATE
SpectraBase Compound ID 5vRHXpefmD9
InChI InChI=1S/C2H2N6O4.Na.3H2O/c9-7(10)2(8(11)12)1-3-5-6-4-1;;;;/h2H,(H,3,4,5,6);;3*1H2/q;+1;;;
InChIKey KIFIOONNYPEXSW-UHFFFAOYSA-N
Mol Weight 251.111 g/mol
Molecular Formula C2H8N6NaO7
Exact Mass 251.035216 g/mol

15N Nuclear Magnetic Resonance (NMR) Chemical Shifts

15N Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4ewvn09E0DI
Name SODIUM-5-DINITROMETHYL-1H-TETRAZOLATE-TRIHYDRATE
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C2H8N6NaO7
InChI InChI=1S/C2H2N6O4.Na.3H2O/c9-7(10)2(8(11)12)1-3-5-6-4-1;;;;/h2H,(H,3,4,5,6);;3*1H2/q;+1;;;
InChIKey KIFIOONNYPEXSW-UHFFFAOYSA-N
Literature Reference Author T.M.KLAPOETKE,F.X.STEEMANN
Literature Reference Citation PROP.EXPL.PYROT.,35,114(2010)
Literature Reference DOI 10.1002/prep.200900049
Solvent DMSO-D6
Source File Reference UWLU78374