German Research Center for Food Chemistry , Lise-Meitner-Straße 34, D-85354 Freising, Germany.
J Agric Food Chem. 2013 Jun 5;61(22):5226-35. doi: 10.1021/jf400807w. Epub 2013 May 21.
Comprehensive two-dimensional gas chromatography-mass spectrometry (GC×GC-MS) has been used a few times to identify and quantitate single aroma-active compounds, but the capability of this technique to monitor a complete set of key odorants evoking the aroma of a given food in one run has not been exploited so far. A fast, multiodorant analysis using GC×GC-TOF-MS in combination with stable isotope dilution assays (SIDA) was developed to quantitate the entire set of aroma compounds, the sensometabolome, of raw and roasted hazelnuts ( Corylus avellana L. 'Tonda Gentile') previously established by GC-olfactometry. The capability of the method to evaluate the aroma contribution of each sensometabolite was evaluated by introducing a new term, the limit of odor activity value (LOAV), indicating whether a given aroma compound can be determined down to an odor activity value (OAV) of 1 (odor activity value = ratio of concentration to odor threshold). The advantage of the new method was proven by comparing the performance parameters with a traditional one-dimensional approach using GC-ion trap mass-spectrometry (GC-IT-MS). The results showed that the detector linearity and sensitivity of GC×GC-TOF-MS was on average higher by a factor of 10 compared to GC-IT-MS, thus enabling the quantitation of the aroma relevant amounts of 22 key odorants of hazelnuts in one run of the 30 aroma-active compounds. Seven novel isotopically labeled internal standards were synthesized to meet the analytical requirements defined by electron impact ionization in TOF-MS, that is, to keep the label. On the basis of the quantitative results obtained, it was possible to closely mimic the aroma of raw and roasted 'Tonda Gentile' hazelnuts by preparing an aroma recombinate containing the key odorants at their natural concentrations occurring in the nuts.
全二维气相色谱-质谱联用技术(GC×GC-MS)已经被用于鉴定和定量分析单个香气活性化合物,但迄今为止,该技术还没有被用于在一次运行中监测一组关键的气味物质,这些物质能引发特定食品的香气。本文开发了一种快速、多气味分析方法,使用 GC×GC-TOF-MS 结合稳定同位素稀释分析(SIDA),以定量分析之前通过 GC-嗅闻仪确定的生榛子和烤榛子( Corylus avellana L. 'Tonda Gentile')的整个香气化合物组,即感代谢组。通过引入一个新术语——气味活性值的极限(LOAV),可以评估该方法评估每个感代谢物的香气贡献的能力,该术语表示给定的香气化合物是否可以在气味活性值(OAV)为 1 时被检测到(气味活性值=浓度与气味阈值的比值)。通过将新方法与传统的一维方法(GC-离子阱质谱法(GC-IT-MS))的性能参数进行比较,证明了新方法的优势。结果表明,与 GC-IT-MS 相比,GC×GC-TOF-MS 的检测器线性度和灵敏度平均提高了 10 倍,从而能够在一次运行中对 30 种香气活性化合物中的 22 种关键气味物质进行定量分析。为了满足 TOF-MS 中电子轰击电离的分析要求,即保持标记,合成了 7 种新型同位素标记的内标。基于获得的定量结果,可以通过制备含有关键气味物质的天然浓度的香气重组体,来模拟生榛子和烤榛子的香气。