title: Confirmation of brand identity of a Trappist beer by mid-infrared spectroscopy coupled with multivariate data analysis.
abstract: Authentication of foods is of importance both to consumers and producers for e.g. confidence in label descriptions and brand protection, respectively. The authentication of beers has received limited attention and in most cases only small data sets were analysed. In this study, Fourier-transform infrared attenuated total reflectance (FT-IR ATR) spectroscopy was applied to a set of 267 beers (53 different brands) to confirm claimed identity for samples of a single beer brand based on their spectral profiles. Skewness-adjusted robust principal component analysis (ROBPCA) was deployed to detect outliers in the data. Subsequently, extended canonical variates analysis (ECVA) was used to reduce the dimensionality of the data while simultaneously achieving maximum class separation. Finally, the reduced data were used as inputs to various linear and non-linear classifiers. Work focused on the specific identification of Rochefort 8° (a Trappist beer) and both direct and indirect (using an hierarchical approach) identification strategies were studied. For the classification problems Rochefort vs. non-Rochefort, Rochefort 8° vs. non-Rochefort 8° and Rochefort 8° vs. Rochefort 6° and 10°, correct prediction abilities of 93.8%, 93.3% and 97.3%, respectively were achieved.
authors.affiliation: Analytical Chemistry, Institute for Molecules and Materials, Radboud University, Heyendaalseweg 135, 6525 AJ Nijmegen, The Netherlands. j.engel@science.ru.nl
authors.forename: Jasper
authors.initials: J
authors.lastname: Engel
authors.forename: Lionel
authors.initials: L
authors.lastname: Blanchet
authors.forename: Lutgarde M C
authors.initials: LM
authors.lastname: Buydens
authors.forename: Gerard
authors.initials: G
authors.lastname: Downey
mesh_terms: D001515:Beer / Q000032:analysis* / Q000592:standards; D015999:Multivariate Analysis; D011786:Quality Control; D017550:Spectroscopy, Fourier Transform Infrared / Q000379:methods*