Independent components–discriminant analysis for discrimination of Brazilian Canephora coffees based on their inorganic fraction: A preliminary chemometric study

中粒咖啡 线性判别分析 主成分分析 化学 化学计量学 偏最小二乘回归 矿物学 分析化学(期刊) 数学 植物 环境化学 色谱法 统计 生物 小粒咖啡
作者
Michel Rocha Baqueta,Augusto César Costa-Santos,Ana Paula Rebellato,Gisele Marcondes Luz,Juliana Azevedo Lima Pallone,Federico Marini,Alexsandro Lara Teixeira,Douglas N. Rutledge,Patrícia Valderrama
出处
期刊:Microchemical Journal [Elsevier BV]
卷期号:196: 109603-109603 被引量:4
标识
DOI:10.1016/j.microc.2023.109603
摘要

Essential element composition of new Brazilian Canephora coffees of specific origins, including both Robusta and Conilon varieties is reported for the first time. A sample set comprising 100 Canephora samples of different geographical origins (Conilon from Espírito Santo, Amazonian Robusta from indigenous and non-indigenous producers from Rondônia, and Conilon from Bahia) and Arabica coffee (25 samples) was analyzed in terms of their essential mineral content by flame atomic absorption spectrometry using diluted nitric acid to characterize their content in Fe, Ca, Zn, Mg, Mn, Cu, and K. A recent chemometric tool, independent components-discriminant analysis (IC-DA), was applied for the first time to analyze mineral composition data. IC-DA discriminated the samples according to the predetermined classes (geographical origins of Canephora and species – Arabica vs. Canephora), identifying the minerals responsible for the discriminations. IC-DA sensitivity and specificity were higher when compared to the partial least square-discriminant analysis (PLS-DA). The method is shown to be suitable to achieve supervised discrimination of samples based on their essential elemental composition, even when principal component analysis had failed. It can thus be used as a tool for origin and species discrimination based on the inorganic fraction of coffee.

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