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3,4,5-TRIAMINO-1,2,4-TRIAZOLIUM-5-NITROTETRAZOLATE

View entire compound with spectra: 2 NMR

3,4,5-TRIAMINO-1,2,4-TRIAZOLIUM-5-NITROTETRAZOLATE
SpectraBase Compound ID 9aVrq6rcP5O
InChI InChI=1S/C2H6N6.CN5O2/c3-1-6-7-2(4)8(1)5;7-6(8)1-2-4-5-3-1/h5H2,(H2,3,6)(H2,4,7);/q;-1/p+1
InChIKey DGSMAWJFPAVIHU-UHFFFAOYSA-O
Mol Weight 229.16 g/mol
Molecular Formula C3H7N11O2
Exact Mass 229.078419 g/mol

15N Nuclear Magnetic Resonance (NMR) Chemical Shifts

15N Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1tncF9tNyrD
Name 3,4,5-TRIAMINO-1,2,4-TRIAZOLIUM-5-NITROTETRAZOLATE
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C3H7N11O2
InChI InChI=1S/C2H6N6.CN5O2/c3-1-6-7-2(4)8(1)5;7-6(8)1-2-4-5-3-1/h5H2,(H2,3,6)(H2,4,7);/q;-1/p+1
InChIKey DGSMAWJFPAVIHU-UHFFFAOYSA-O
Literature Reference Author C.DARWICH,T.M.KLAPOETKE,J.M.WELCH,M.SUCESKA
Literature Reference Citation PROP.EXPL.PYROT.,32,235(2007)
Literature Reference DOI 10.1002/prep.200700025
Solvent DMSO-D6
Source File Reference UWLU80872