Analysis Metabolite Name Measured Value Units Pair Timepoint Treatment response
Reversed phase POSITIVE ION MODECAFFEINE (CAS# 58-08-2); (M+H)+1730Peak areaPair 2 T0 Yes
Reversed phase POSITIVE ION MODECAFFEINE (CAS# 58-08-2); (M+H)+5419Peak areaPair 6 T0 Yes
Reversed phase POSITIVE ION MODECAFFEINE (CAS# 58-08-2); (M+H)+27628Peak areaPair 7 T0 Yes
Reversed phase POSITIVE ION MODECAFFEINE (CAS# 58-08-2); (M+H)+39006Peak areaPair 4 T2 No
Reversed phase POSITIVE ION MODECAFFEINE (CAS# 58-08-2); (M+H)+40984Peak areaPair 4 T2 Yes
Reversed phase POSITIVE ION MODECAFFEINE (CAS# 58-08-2); (M+H)+42684Peak areaPair 4 T0 Yes
Reversed phase POSITIVE ION MODECAFFEINE (CAS# 58-08-2); (M+H)+46046Peak areaPair 3 T0 No
Reversed phase POSITIVE ION MODECAFFEINE (CAS# 58-08-2); (M+H)+50375Peak areaPair 8 T2 Yes
Reversed phase POSITIVE ION MODECAFFEINE (CAS# 58-08-2); (M+H)+74548Peak areaPair 5 T0 Yes
Reversed phase POSITIVE ION MODECAFFEINE (CAS# 58-08-2); (M+H)+80078Peak areaPair 7 T2 No
Reversed phase POSITIVE ION MODECAFFEINE (CAS# 58-08-2); (M+H)+81407Peak areaPair 5 T2 Yes
Reversed phase POSITIVE ION MODECAFFEINE (CAS# 58-08-2); (M+H)+197687Peak areaPair 3 T2 Yes
Reversed phase POSITIVE ION MODECAFFEINE (CAS# 58-08-2); (M+H)+199526Peak areaPair 1 T2 No
Reversed phase POSITIVE ION MODECAFFEINE (CAS# 58-08-2); (M+H)+218691Peak areaPair 8 T2 No
Reversed phase POSITIVE ION MODECAFFEINE (CAS# 58-08-2); (M+H)+299720Peak areaPair 8 T0 No
Reversed phase POSITIVE ION MODECAFFEINE (CAS# 58-08-2); (M+H)+302903Peak areaPair 6 T2 Yes
Reversed phase POSITIVE ION MODECAFFEINE (CAS# 58-08-2); (M+H)+343558Peak areaPair 6 T0 No
Reversed phase POSITIVE ION MODECAFFEINE (CAS# 58-08-2); (M+H)+394194Peak areaPair 1 T0 No
Reversed phase POSITIVE ION MODECAFFEINE (CAS# 58-08-2); (M+H)+486846Peak areaPair 5 T0 No
Reversed phase POSITIVE ION MODECAFFEINE (CAS# 58-08-2); (M+H)+702146Peak areaPair 7 T2 Yes
Reversed phase POSITIVE ION MODECAFFEINE (CAS# 58-08-2); (M+H)+954239Peak areaPair 6 T2 No
Reversed phase POSITIVE ION MODECAFFEINE (CAS# 58-08-2); (M+H)+1094952Peak areaPair 1 T2 Yes
Reversed phase POSITIVE ION MODECAFFEINE (CAS# 58-08-2); (M+H)+1408583Peak areaPair 1 T0 Yes
Reversed phase POSITIVE ION MODECAFFEINE (CAS# 58-08-2); (M+H)+1700651Peak areaPair 5 T2 No
Reversed phase POSITIVE ION MODECAFFEINE (CAS# 58-08-2); (M+H)+2110233Peak areaPair 3 T0 Yes
Reversed phase POSITIVE ION MODECAFFEINE (CAS# 58-08-2); (M+H)+5364520Peak areaPair 2 T2 No
Reversed phase POSITIVE ION MODECAFFEINE (CAS# 58-08-2); (M+H)+6056116Peak areaPair 2 T0 No
Reversed phase POSITIVE ION MODECAFFEINE (CAS# 58-08-2); (M+H)+Peak areaPair 2 T2 Yes
Reversed phase POSITIVE ION MODECAFFEINE (CAS# 58-08-2); (M+H)+Peak areaPair 3 T2 No
Reversed phase POSITIVE ION MODECAFFEINE (CAS# 58-08-2); (M+H)+Peak areaPair 4 T0 No
Reversed phase POSITIVE ION MODECAFFEINE (CAS# 58-08-2); (M+H)+Peak areaPair 7 T0 No
Reversed phase POSITIVE ION MODECAFFEINE (CAS# 58-08-2); (M+H)+Peak areaPair 8 T0 Yes
Reversed phase POSITIVE ION MODECAFFEINE (CAS# 58-08-2); (M+NA)+1544Peak areaPair 1 T2 Yes
Reversed phase POSITIVE ION MODECAFFEINE (CAS# 58-08-2); (M+NA)+2990Peak areaPair 6 T2 No
Reversed phase POSITIVE ION MODECAFFEINE (CAS# 58-08-2); (M+NA)+16955Peak areaPair 2 T0 No
Reversed phase POSITIVE ION MODECAFFEINE (CAS# 58-08-2); (M+NA)+Peak areaPair 1 T0 No
Reversed phase POSITIVE ION MODECAFFEINE (CAS# 58-08-2); (M+NA)+Peak areaPair 1 T0 Yes
Reversed phase POSITIVE ION MODECAFFEINE (CAS# 58-08-2); (M+NA)+Peak areaPair 1 T2 No
Reversed phase POSITIVE ION MODECAFFEINE (CAS# 58-08-2); (M+NA)+Peak areaPair 2 T0 Yes
Reversed phase POSITIVE ION MODECAFFEINE (CAS# 58-08-2); (M+NA)+Peak areaPair 2 T2 No
Reversed phase POSITIVE ION MODECAFFEINE (CAS# 58-08-2); (M+NA)+Peak areaPair 2 T2 Yes
Reversed phase POSITIVE ION MODECAFFEINE (CAS# 58-08-2); (M+NA)+Peak areaPair 3 T0 No
Reversed phase POSITIVE ION MODECAFFEINE (CAS# 58-08-2); (M+NA)+Peak areaPair 3 T0 Yes
Reversed phase POSITIVE ION MODECAFFEINE (CAS# 58-08-2); (M+NA)+Peak areaPair 3 T2 No
Reversed phase POSITIVE ION MODECAFFEINE (CAS# 58-08-2); (M+NA)+Peak areaPair 3 T2 Yes
Reversed phase POSITIVE ION MODECAFFEINE (CAS# 58-08-2); (M+NA)+Peak areaPair 4 T0 No
Reversed phase POSITIVE ION MODECAFFEINE (CAS# 58-08-2); (M+NA)+Peak areaPair 4 T0 Yes
Reversed phase POSITIVE ION MODECAFFEINE (CAS# 58-08-2); (M+NA)+Peak areaPair 4 T2 No
Reversed phase POSITIVE ION MODECAFFEINE (CAS# 58-08-2); (M+NA)+Peak areaPair 4 T2 Yes
Reversed phase POSITIVE ION MODECAFFEINE (CAS# 58-08-2); (M+NA)+Peak areaPair 5 T0 No
Reversed phase POSITIVE ION MODECAFFEINE (CAS# 58-08-2); (M+NA)+Peak areaPair 5 T0 Yes
Reversed phase POSITIVE ION MODECAFFEINE (CAS# 58-08-2); (M+NA)+Peak areaPair 5 T2 No
Reversed phase POSITIVE ION MODECAFFEINE (CAS# 58-08-2); (M+NA)+Peak areaPair 5 T2 Yes
Reversed phase POSITIVE ION MODECAFFEINE (CAS# 58-08-2); (M+NA)+Peak areaPair 6 T0 No
Reversed phase POSITIVE ION MODECAFFEINE (CAS# 58-08-2); (M+NA)+Peak areaPair 6 T0 Yes
Reversed phase POSITIVE ION MODECAFFEINE (CAS# 58-08-2); (M+NA)+Peak areaPair 6 T2 Yes
Reversed phase POSITIVE ION MODECAFFEINE (CAS# 58-08-2); (M+NA)+Peak areaPair 7 T0 No
Reversed phase POSITIVE ION MODECAFFEINE (CAS# 58-08-2); (M+NA)+Peak areaPair 7 T0 Yes
Reversed phase POSITIVE ION MODECAFFEINE (CAS# 58-08-2); (M+NA)+Peak areaPair 7 T2 No
Reversed phase POSITIVE ION MODECAFFEINE (CAS# 58-08-2); (M+NA)+Peak areaPair 7 T2 Yes
Reversed phase POSITIVE ION MODECAFFEINE (CAS# 58-08-2); (M+NA)+Peak areaPair 8 T0 No
Reversed phase POSITIVE ION MODECAFFEINE (CAS# 58-08-2); (M+NA)+Peak areaPair 8 T0 Yes
Reversed phase POSITIVE ION MODECAFFEINE (CAS# 58-08-2); (M+NA)+Peak areaPair 8 T2 No
Reversed phase POSITIVE ION MODECAFFEINE (CAS# 58-08-2); (M+NA)+Peak areaPair 8 T2 Yes

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