Determination of nicotine, glycerol, propylene glycol and water in electronic cigarette fluids using quantitative 1H NMR

The variability of the electronic cigarette liquids (e-liquid) composition has the potential to influence not only the amount of nicotine delivered to the user, but also the type and amount of generated byproducts and subsequent health risks. For this reason, it is important to characterize all of the chemical components of e-liquids. We report the development and application of a single 1 H NMR analysis method to identify and quantify the most abundant chemical components (nicotine, glycerol, 1,2-propylene glycol, and water) likely to be present as their influence on the composition of inhaled vapor is not know. For 1 H NMR, the solvent has to dissolve the e-liquids at a concentration sufficient to readily determine the concentration of nicotine present, and the solvent and internal standard cannot possess exchangeable protons which would interfere with determining the concentrations of the analytes of interest. To fulfill these requirements, perdeuterated N,N -dimethylformamide (DMF- d 7 ) was selected as the solvent, with 1,2,4,5-tetrachloro-3-nitrobenzene as the internal standard. Nicotine concentrations from 58 different e-liquids obtained using 1 H NMR were found to agree with the results from GC-MS analysis. Generally, the amount of nicotine present was close to that claimed by the manufacturer. In some cases, the proportions of 1,2-propylene glycol, glycerol, and water varied significantly between flavors within a brand and within flavors depending on the nicotine content. In one case, 1,2-propylene glycol was identified where the manufacturer had stated none should be present. E-liquids containing nicotine, propylene glycol, glycerol, and water from electronic cigarettes are quantitatively analyzed by a single 1 H NMR analysis.