Related Experiment Video
Updated: May 26, 2026

Identification and Quantification of Decomposition Mechanisms in Lithium-Ion Batteries; Input to Heat Flow Simulation for Modeling Thermal Runaway
Published on: March 7, 2022
Decomposition of aminotetrazole based energetic materials under high heating rate conditions
Nicholas Piekiel1, Michael R Zachariah
1Department of Mechanical Engineering, University of Maryland, College Park, Maryland 20742, United States.
Abstract:
A T-jump/time-of-flight mass spectrometer (T-Jump/TOFMS) is used to probe the decomposition of several aminotetrazole containing energetic materials under very high heating rates of 10(5)-10(6) K/s. The materials investigated are 5-amino-1-methyl-1H-tetrazolium dinitramide (MeHAT_DN), 1,5-diamino-4-methyl-1H-tetrazolium dinitramide (MeDAT_DN), 1,5-diamino-1H-tetrazolium nitrate (DAT_N), 1,5-diamino-4-methyl-1H-tetrazolium azide (MeDAT_N3), and 5-aminotetrazolium dinitramide (HAT_DN). Subtle differences between materials in functional group placement and anion composition allow for further understanding of the decomposition pathway of the tetrazole structure and various anions. Two decomposition pathways for the tetrazole ring are observed, which result in the primary formation of HN(3) or N(2). The N(2) formation pathway occurs when functional groups are placed symmetrically around the tetrazole ring, whereas asymmetric placement results in HN(3) production. The differing anion compositions also show effects on thermal stability of the salts, as is demonstrated by a lower decomposition temperature for the azide containing salt compared to the similar dinitramide containing material. For the decomposition of the dinitramide molecule, high temperature (N(2)O forming) and low temperature (NO(2) forming) decomposition pathways are observed, as has been previously suggested.
Related Concept Videos
Atomic Absorption Spectroscopy: Atomization Methods
2° Amines to N-Nitrosamines: Reaction with NaNO2
1° Amines to Diazonium or Aryldiazonium Salts: Diazotization with NaNO2 Mechanism
Mass Spectrometry of Amines
Mass Spectrometry: Amine Fragmentation
In amines, the number of nitrogen atoms affects the mass of the molecular ion, which is described by the nitrogen rule of mass spectrometry. This rule states that a compound containing a single or...
1° Amines to Diazonium or Aryldiazonium Salts: Diazotization with NaNO2 Overview
The nitrous acid is unstable. Hence, it is formed in situ from a solution of sodium nitrite and cold aqueous acids such as hydrochloric or sulfuric acid. In an acidic solution, the –OH group of nitrous acid undergoes protonation to give oxonium ion, followed by water loss...

