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_S13_Kampo_033_1-13_01_4431
pospos
Yes
N_S13_Kampo_033_1-13_01_4433
negneg
Yes
P_Mock_210925_1_1-31_01_4391
pospos
Yes
P_Mock_210925_1_1-31_01_4459
pospos
Yes
N_Mock_210925_1_1-31_01_4393
negneg
Yes
N_Mock_210925_1_1-31_01_4461
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