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_S03_Kampo_050_1-3_01_7486
pospos
Yes
N_S03_Kampo_050_1-3_01_7488
negneg
Yes
P_Mock_211227_1_1-91_01_7470
pospos
Yes
P_Mock_211227_2_1-91_01_7654
pospos
Yes
N_Mock_211227_1_1-91_01_7472
negneg
Yes
N_Mock_211227_2_1-91_01_7656
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