Enhancing natural products annotation in dual 13C-NMR and LC-HRMS2 based complex mixtures chemical profiling through custom in silico databasesdoi:10.1055/s-0042-1759205Cordonnier, JRemy, SKotland, ALeroy, RMartinez, ABorie, NSayagh, C
Anal Bioanal Chem (2015) 407:8019–8033 DOI 10.1007/s00216-015-8975-9 RESEARCH PAPER Tracing the metabolism of HT-2 toxin and T-2 toxin in barley by isotope-assisted untargeted screening and quantitative LC-HRMS analysis Jacqueline Meng-Reiterer1,2 & Elisabeth Varga1,3 & Alexis V. Nathan...
Finally, we provide an optimization workflow of MZmine 2 for LC-HRMS data processing that is applicable for environmental samples for nontarget screening. The results also show that the DoE approach is useful and effort-saving for optimizing data processing parameters. Graphical谩.doi:10.1007/s002...
血液液相色谱-高分辨质谱(LC-HRMS)QExactive质谱代谢物为准确测定小鼠血液中4-(N-甲基-N-亚硝氨基)-1-(3-吡啶基)-1-丁酮(NNK)及其代谢物,了解小鼠体内NNK的代谢途径,利用Q Exactive轨道阱高分辨质谱仪,建立了一种同时检测C57BL/6小鼠血液中NNK及其7种代谢物[4-(N-甲基-N-亚硝氨基)-1-(3-吡啶基)-1...
LC-HRMS/MSN-MethylBis(2-(Alkyloxy-Alkylphosphoryloxy)Ethyl)AminesFragmentationPathwaysAnalysisN-Methyl bis(2-(alkyloxy-alkylphosphoryloxy)ethyl)amines, which are abbreviated as PNPs, are a series of new skeleton chemicals belonging to schedule 2.B.04 chemicals of Chemical Weapons Convention (CWC)....
Chemical WeaponsLC-HRMS/MSN-Methyl Bis(2-(Alkyloxy-Alkylphosphoryloxy)Ethyl)AminesFragmentation PathwaysAnalysisN-Methyl bis(2-(alkyloxy-alkylphosphoryloxy)ethyl)aminesdoi:10.4236/ajac.2014.513091Hui-Lan YuShi-Lei LiuDao-Ming SunCheng-Xin PeiYu XiangScientific Research美国分析化学(英文)...
Brain lipid extracts were obtained using a Folch modified partition from adjacent rat tissue sections (卤 2-3mg) [2]. The lower phase containing sulfatide species underwent further separation using LCNH2 columns [3]. The resulting fractions were dried and dissolved in methanol prior to LC-HRMS ...
Detecting and grouping isotope m/z relations among LC-HRMS centroid peaks, based on quantized reference dataMartin Loos
Analytical and Bioanalytical Chemistry Electronic Supplementary Material Tracing the metabolism of HT-2 toxin and T-2 toxin in barley by isotope assisted untargeted screening and quantitative LC-HRMS analysis Jacqueline Meng-Reiterer, Elisabeth Varga, Alexis V. Nathanail, Christoph Bueschl, Justyna Rech...