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_S11_Kampo_090_1-11_01_9245
pospos
Yes
N_S11_Kampo_090_1-11_01_9247
negneg
Yes
P_Mock_220318_1_1-91_01_9181
pospos
Yes
P_Mock_220318_2_1-91_01_9260
pospos
Yes
N_Mock_220318_1_1-91_01_9183
negneg
Yes
N_Mock_220318_2_1-91_01_9253
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