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_005_1-11_01_2660
pospos
Yes
N_S11_Kampo_005_1-11_01_2662
negneg
Yes
P_Mock_210703_1_1-31_01_2596
pospos
Yes
P_Mock_210703_2_1-31_01_2702
pospos
Yes
N_Mock_210703_1_1-31_01_2598
negneg
Yes
N_Mock_210703_2_1-31_01_2704
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