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1-METHYL-2,4,5-TRINITROIMIDAZOLE

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1-METHYL-2,4,5-TRINITROIMIDAZOLE
SpectraBase Compound ID FC0nHXVg8lb
InChI InChI=1S/C4H3N5O6/c1-6-3(8(12)13)2(7(10)11)5-4(6)9(14)15/h1H3
InChIKey MNYFLTUIJHCVIQ-UHFFFAOYSA-N
Mol Weight 217.1 g/mol
Molecular Formula C4H3N5O6
Exact Mass 217.008333 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6N99lAiMhYW
Name 1-METHYL-2,4,5-TRINITROIMIDAZOLE
Compound Number 6
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C4H3N5O6
InChI InChI=1S/C4H3N5O6/c1-6-3(8(12)13)2(7(10)11)5-4(6)9(14)15/h1H3
InChIKey MNYFLTUIJHCVIQ-UHFFFAOYSA-N
Literature Reference Author P.RAVI,S.P.TEWARI
Literature Reference Citation PROP.EXPL.PYROT.,37,544(2012)
Literature Reference DOI 10.1002/prep.201100044
Molecular Weight 217.098 g/mol
Solvent CDCl3
Source File Reference UWLU78356