Rapid and interference-free analysis of nine B-group vitamins in energy drinks using trilinear component modeling of liquid chromatography-mass spectrometry data

Talanta. 2018 Apr 1:180:108-119. doi: 10.1016/j.talanta.2017.12.036. Epub 2017 Dec 15.

Abstract

The aim of the present work was to develop a rapid and interference-free method based on liquid chromatography-mass spectrometry (LC-MS) for the simultaneous determination of nine B-group vitamins in various energy drinks. A smart and green strategy that modeled the three-way data array of LC-MS with second-order calibration methods based on alternating trilinear decomposition (ATLD) and alternating penalty trilinear decomposition (APTLD) algorithms was developed. By virtue of "mathematical separation" and "second-order advantage", the proposed strategy successfully solved the co-eluted peaks and unknown interferents in LC-MS analysis with the elution time less than 4.5min and simple sample preparation. Satisfactory quantitative results were obtained by the ATLD-LC-MS and APTLD-LC-MS methods for the spiked recovery assays, with the average spiked recoveries ranging from 87.2-113.9% to 92.0-111.7%, respectively. These results acquired from the proposed methods were confirmed by the LC-MS/MS method, which shows a quite good consistency with each other. All these results demonstrated that the developed chemometrics-assisted LC-MS strategy had advantages of being rapid, green, accurate and low-cost, and it could be an attractive alternative for the determination of multiple vitamins in complex food matrices, which required no laborious sample preparation, tedious condition optimization or more sophisticated instrumentations.

Keywords: B-group vitamins; Energy drink; Liquid chromatography–mass spectrometry; Mathematical separation; Second-order advantage; Second-order calibration method.

Publication types

  • Evaluation Study

MeSH terms

  • Algorithms
  • Calibration
  • Chromatography, Liquid / economics
  • Chromatography, Liquid / methods*
  • Energy Drinks / analysis*
  • Food Analysis / economics
  • Food Analysis / methods*
  • Limit of Detection
  • Linear Models
  • Niacinamide / analysis
  • Pantothenic Acid / analysis
  • Spectrometry, Mass, Electrospray Ionization / economics
  • Spectrometry, Mass, Electrospray Ionization / methods
  • Tandem Mass Spectrometry / economics
  • Tandem Mass Spectrometry / methods*
  • Thiamine / analysis
  • Vitamin B 12 / analysis
  • Vitamin B 6 / analysis
  • Vitamin B Complex / analysis*

Substances

  • Vitamin B Complex
  • Pantothenic Acid
  • Niacinamide
  • Vitamin B 6
  • Vitamin B 12
  • Thiamine