The file includes the peak list, MSn data, and definition files of adduct ions detected for positive and negative modes. Please note that we do not change these download files even if we update the data, such as compound database search results. Please see the “Previous Data” to get the latest data.
Chromatogram Files
File Name
Mode
Used*
mzXML.zip
Metadata*
P_S02_Kampo_stomach_medicine2_1-2_01_12119
pospos
Yes
N_S02_Kampo_stomach_medicine2_1-2_01_12121
negneg
Yes
P_Mock_220706_1_1-91_01_12115
pospos
Yes
P_Mock_220706_2_1-91_01_12161
pospos
Yes
N_Mock_220706_1_1-91_01_12117
negneg
Yes
N_Mock_220706_2_1-91_01_12163
negneg
Yes
*Used
The data files used for the peak detection and alignment in this website are marked with "yes". *Metadata
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Thing Metabolome Repository