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_S08_Kampo_071_1-8_01_8226
pospos
Yes
N_S08_Kampo_071_1-8_01_8228
negneg
Yes
P_Mock_220210_1_1-91_01_8174
pospos
Yes
P_Mock_220210_2_1-91_01_8256
pospos
Yes
N_Mock_220210_1_1-91_01_8176
negneg
Yes
N_Mock_220210_2_1-91_01_8258
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