Discrimination of centre composition in panned chocolate goods using near infrared spectroscopy

IF 1.6 4区 化学 Q3 CHEMISTRY, APPLIED Journal of Near Infrared Spectroscopy Pub Date : 2022-04-25 DOI:10.1177/09670335221085616
Joel B. Johnson
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引用次数: 1

Abstract

Non-destructively identifying the centre composition of panned chocolate goods may be useful in quality assurance settings. However, no studies to date have investigated this topic. In this study, near infrared spectra (1000–2500 nm) were collected from chocolate-coated peanuts and chocolate-coated sultanas (n = 170 of each) in order to investigate the prospect of non-invasively detecting the composition of the centre. Principal component analysis confirmed that the spectra of these samples were distinct from one another. The partial least squares discriminant analysis (PLS-DA) model showed a high level of separation between chocolate-coated peanuts and sultanas in the training set (R2 = 0.95; RPD = 4.4). Discrimination between peanut and sultana samples from an independent test set was also possible, although with slightly less distinct separation between the sample types. A soft independent modelling by class analogy model was also able to differentiate between the two sample types, albeit with higher levels of misclassification compared to PLS-DA. Incorporating samples from different manufacturers may be useful for improving the broader applicability of the model.
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近红外光谱法判别焙烤巧克力制品中的中心成分
非破坏性地识别包装巧克力产品的中心成分可能在质量保证设置有用。然而,迄今为止还没有研究调查过这个话题。本研究收集了巧克力花生和巧克力苏丹豆(各170个)的近红外光谱(1000-2500 nm),以探讨非侵入性检测中心成分的前景。主成分分析证实了这些样品的光谱是不同的。偏最小二乘判别分析(PLS-DA)模型显示,在训练集中,巧克力花生和苏丹花生之间存在高度的分离(R2 = 0.95;RPD = 4.4)。从一个独立的测试集区分花生和苏丹样品也是可能的,尽管样品类型之间的区分稍微不那么明显。通过类类比模型的软独立建模也能够区分两种样本类型,尽管与PLS-DA相比有更高的错误分类水平。合并来自不同制造商的样本可能有助于提高模型的广泛适用性。
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来源期刊
CiteScore
3.30
自引率
5.60%
发文量
35
审稿时长
6 months
期刊介绍: JNIRS — Journal of Near Infrared Spectroscopy is a peer reviewed journal, publishing original research papers, short communications, review articles and letters concerned with near infrared spectroscopy and technology, its application, new instrumentation and the use of chemometric and data handling techniques within NIR.
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