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
Method
Used*
mzXML.zip
raw.zip
Metadata*
16016_Whisky_Method1
pospos
1
Yes
16016_Whisky_Method5
pospos
5
Yes
16016_Whisky_nega
negneg
1
Yes
Mock_17016
pospos
1
Yes
Mock_170614
pospos
1
Yes
Mock_170619
pospos
1
Yes
Mock_170621
pospos
1
Yes
Mock_170623
pospos
1
Yes
Mock_170626
pospos
1
Yes
Mock_170614_nega
negneg
1
Yes
Mock_170616_nega
negneg
1
Yes
Mock_170619_nega
negneg
1
Yes
Mock_170621_nega
negneg
1
Yes
Mock_170623_nega
negneg
1
Yes
Mock_170626_nega
negneg
1
Yes
*Used
The data files used for the peak detection and alignment in this website are marked with "yes". *Metadata
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Food Metabolome Repository