Kessler Pavel, Godejohann Markus
Bruker BioSpin GmbH, Silberstreifen 4, 76287, Rheinstetten, Germany.
Magn Reson Chem. 2018 Jun;56(6):480-492. doi: 10.1002/mrc.4712. Epub 2018 Jan 30.
This paper introduces CMC-se-a program for computer-assisted structure elucidation. In the experimental part, the combination of modern analytical methods (LC-SPE-NMR/MS) and structure elucidation software is used for the identification of tentative markers in red wines.
本文介绍了一种用于计算机辅助结构解析的CMC-se-a程序。在实验部分,现代分析方法(液相色谱-固相萃取-核磁共振/质谱联用技术,LC-SPE-NMR/MS)与结构解析软件相结合,用于鉴定红葡萄酒中的暂定标志物。