Metabolomics Workbench : NIH Data Repository

Analysis	Metabolite Name	Measured Value	Units	CASE_CONTROL	Chemotherapy	Drug	Race	TIMEPOINT	Tamoxyfen	Taxane
Reversed phase POSITIVE ION MODE	CAFFEINE (CAS# 58-08-2); (M+H)+	11936	Peak area	Case	N	Letrozole	White	Baseline	N	N
Reversed phase POSITIVE ION MODE	CAFFEINE (CAS# 58-08-2); (M+H)+	17669	Peak area	Case	Y	Exemestane	White	3 Month	N	Y
Reversed phase POSITIVE ION MODE	CAFFEINE (CAS# 58-08-2); (M+H)+	19381	Peak area	Case	Y	Letrozole	White	Baseline	Y	Y
Reversed phase POSITIVE ION MODE	CAFFEINE (CAS# 58-08-2); (M+H)+	34751	Peak area	Case	Y	Exemestane	White	3 Month	N	Y
Reversed phase POSITIVE ION MODE	CAFFEINE (CAS# 58-08-2); (M+H)+	36629	Peak area	Case	N	Exemestane	White	3 Month	Y	N
Reversed phase POSITIVE ION MODE	CAFFEINE (CAS# 58-08-2); (M+H)+	38537	Peak area	Case	N	Letrozole	Black	3 Month	N	N
Reversed phase POSITIVE ION MODE	CAFFEINE (CAS# 58-08-2); (M+H)+	38599	Peak area	Case	Y	Exemestane	White	Baseline	Y	Y
Reversed phase POSITIVE ION MODE	CAFFEINE (CAS# 58-08-2); (M+H)+	41257	Peak area	Control	Y	Exemestane	White	Baseline	Y	N
Reversed phase POSITIVE ION MODE	CAFFEINE (CAS# 58-08-2); (M+H)+	41990	Peak area	Case	Y	Letrozole	White	Baseline	Y	Y
Reversed phase POSITIVE ION MODE	CAFFEINE (CAS# 58-08-2); (M+H)+	42388	Peak area	Control	Y	Exemestane	White	3 Month	N	Y
Reversed phase POSITIVE ION MODE	CAFFEINE (CAS# 58-08-2); (M+H)+	46144	Peak area	Control	Y	Exemestane	White	Baseline	N	Y
Reversed phase POSITIVE ION MODE	CAFFEINE (CAS# 58-08-2); (M+H)+	51387	Peak area	Control	N	Exemestane	White	3 Month	N	N
Reversed phase POSITIVE ION MODE	CAFFEINE (CAS# 58-08-2); (M+H)+	57440	Peak area	Case	Y	Exemestane	White	Baseline	N	Y
Reversed phase POSITIVE ION MODE	CAFFEINE (CAS# 58-08-2); (M+H)+	61730	Peak area	Control	N	Exemestane	White	3 Month	N	N
Reversed phase POSITIVE ION MODE	CAFFEINE (CAS# 58-08-2); (M+H)+	65304	Peak area	Case	N	Letrozole	White	Baseline	Y	N
Reversed phase POSITIVE ION MODE	CAFFEINE (CAS# 58-08-2); (M+H)+	66161	Peak area	Case	N	Letrozole	Black	Baseline	N	N
Reversed phase POSITIVE ION MODE	CAFFEINE (CAS# 58-08-2); (M+H)+	67174	Peak area	Control	N	Exemestane	White	Baseline	Y	N
Reversed phase POSITIVE ION MODE	CAFFEINE (CAS# 58-08-2); (M+H)+	87203	Peak area	Case	Y	Exemestane	White	Baseline	N	Y
Reversed phase POSITIVE ION MODE	CAFFEINE (CAS# 58-08-2); (M+H)+	90883	Peak area	Case	Y	Exemestane	Black	Baseline	N	Y
Reversed phase POSITIVE ION MODE	CAFFEINE (CAS# 58-08-2); (M+H)+	91455	Peak area	Control	Y	Letrozole	White	Baseline	Y	N
Reversed phase POSITIVE ION MODE	CAFFEINE (CAS# 58-08-2); (M+H)+	98582	Peak area	Case	Y	Exemestane	White	3 Month	N	Y
Reversed phase POSITIVE ION MODE	CAFFEINE (CAS# 58-08-2); (M+H)+	99956	Peak area	Control	Y	Letrozole	White	Baseline	Y	Y
Reversed phase POSITIVE ION MODE	CAFFEINE (CAS# 58-08-2); (M+H)+	101092	Peak area	Control	Y	Exemestane	White	Baseline	Y	Y
Reversed phase POSITIVE ION MODE	CAFFEINE (CAS# 58-08-2); (M+H)+	108720	Peak area	Control	Y	Exemestane	White	Baseline	N	N
Reversed phase POSITIVE ION MODE	CAFFEINE (CAS# 58-08-2); (M+H)+	113930	Peak area	Case	Y	Exemestane	White	Baseline	N	Y
Reversed phase POSITIVE ION MODE	CAFFEINE (CAS# 58-08-2); (M+H)+	120171	Peak area	Case	N	Letrozole	White	3 Month	Y	N
Reversed phase POSITIVE ION MODE	CAFFEINE (CAS# 58-08-2); (M+H)+	123208	Peak area	Case	Y	Letrozole	White	3 Month	Y	Y
Reversed phase POSITIVE ION MODE	CAFFEINE (CAS# 58-08-2); (M+H)+	124000	Peak area	Case	N	Exemestane	White	Baseline	Y	N
Reversed phase POSITIVE ION MODE	CAFFEINE (CAS# 58-08-2); (M+H)+	126937	Peak area	Control	Y	Exemestane	White	3 Month	N	N
Reversed phase POSITIVE ION MODE	CAFFEINE (CAS# 58-08-2); (M+H)+	134721	Peak area	Control	N	Letrozole	White	Baseline	N	N
Reversed phase POSITIVE ION MODE	CAFFEINE (CAS# 58-08-2); (M+H)+	147769	Peak area	Control	Y	Letrozole	White	3 Month	Y	N
Reversed phase POSITIVE ION MODE	CAFFEINE (CAS# 58-08-2); (M+H)+	160054	Peak area	Case	N	Exemestane	White	Baseline	Y	N
Reversed phase POSITIVE ION MODE	CAFFEINE (CAS# 58-08-2); (M+H)+	161378	Peak area	Control	Y	Letrozole	White	3 Month	Y	Y
Reversed phase POSITIVE ION MODE	CAFFEINE (CAS# 58-08-2); (M+H)+	169000	Peak area	Control	N	Letrozole	White	3 Month	Y	N
Reversed phase POSITIVE ION MODE	CAFFEINE (CAS# 58-08-2); (M+H)+	174753	Peak area	Control	Y	Exemestane	White	3 Month	N	Y
Reversed phase POSITIVE ION MODE	CAFFEINE (CAS# 58-08-2); (M+H)+	184952	Peak area	Control	N	Letrozole	Black	Baseline	N	N
Reversed phase POSITIVE ION MODE	CAFFEINE (CAS# 58-08-2); (M+H)+	210589	Peak area	Case	Y	Exemestane	White	3 Month	Y	Y
Reversed phase POSITIVE ION MODE	CAFFEINE (CAS# 58-08-2); (M+H)+	211917	Peak area	Control	Y	Exemestane	White	3 Month	Y	Y
Reversed phase POSITIVE ION MODE	CAFFEINE (CAS# 58-08-2); (M+H)+	218243	Peak area	Control	N	Letrozole	White	3 Month	N	N
Reversed phase POSITIVE ION MODE	CAFFEINE (CAS# 58-08-2); (M+H)+	220702	Peak area	Control	N	Letrozole	White	Baseline	Y	N
Reversed phase POSITIVE ION MODE	CAFFEINE (CAS# 58-08-2); (M+H)+	221011	Peak area	Control	Y	Letrozole	White	3 Month	Y	Y
Reversed phase POSITIVE ION MODE	CAFFEINE (CAS# 58-08-2); (M+H)+	221987	Peak area	Case	N	Exemestane	White	Baseline	N	N
Reversed phase POSITIVE ION MODE	CAFFEINE (CAS# 58-08-2); (M+H)+	238330	Peak area	Control	N	Exemestane	Black	Baseline	Y	N
Reversed phase POSITIVE ION MODE	CAFFEINE (CAS# 58-08-2); (M+H)+	248830	Peak area	Control	Y	Exemestane	White	Baseline	N	Y
Reversed phase POSITIVE ION MODE	CAFFEINE (CAS# 58-08-2); (M+H)+	262251	Peak area	Case	N	Letrozole	White	Baseline	N	N
Reversed phase POSITIVE ION MODE	CAFFEINE (CAS# 58-08-2); (M+H)+	279270	Peak area	Case	Y	Exemestane	White	Baseline	Y	N
Reversed phase POSITIVE ION MODE	CAFFEINE (CAS# 58-08-2); (M+H)+	291582	Peak area	Control	N	Letrozole	White	Baseline	Y	N
Reversed phase POSITIVE ION MODE	CAFFEINE (CAS# 58-08-2); (M+H)+	315297	Peak area	Control	Y	Exemestane	White	Baseline	Y	N
Reversed phase POSITIVE ION MODE	CAFFEINE (CAS# 58-08-2); (M+H)+	349902	Peak area	Control	N	Exemestane	White	Baseline	N	N
Reversed phase POSITIVE ION MODE	CAFFEINE (CAS# 58-08-2); (M+H)+	410332	Peak area	Case	Y	Exemestane	Black	3 Month	N	Y
Reversed phase POSITIVE ION MODE	CAFFEINE (CAS# 58-08-2); (M+H)+	490384	Peak area	Control	Y	Exemestane	White	3 Month	Y	N
Reversed phase POSITIVE ION MODE	CAFFEINE (CAS# 58-08-2); (M+H)+	505838	Peak area	Case	Y	Letrozole	White	Baseline	Y	Y
Reversed phase POSITIVE ION MODE	CAFFEINE (CAS# 58-08-2); (M+H)+	552468	Peak area	Case	N	Letrozole	White	3 Month	N	N
Reversed phase POSITIVE ION MODE	CAFFEINE (CAS# 58-08-2); (M+H)+	569138	Peak area	Case	Y	Exemestane	White	3 Month	Y	N
Reversed phase POSITIVE ION MODE	CAFFEINE (CAS# 58-08-2); (M+H)+	574188	Peak area	Case	Y	Exemestane	White	Baseline	Y	Y
Reversed phase POSITIVE ION MODE	CAFFEINE (CAS# 58-08-2); (M+H)+	576903	Peak area	Control	N	Letrozole	White	3 Month	Y	N
Reversed phase POSITIVE ION MODE	CAFFEINE (CAS# 58-08-2); (M+H)+	617735	Peak area	Case	Y	Exemestane	White	3 Month	Y	N
Reversed phase POSITIVE ION MODE	CAFFEINE (CAS# 58-08-2); (M+H)+	625957	Peak area	Case	Y	Letrozole	White	3 Month	Y	Y
Reversed phase POSITIVE ION MODE	CAFFEINE (CAS# 58-08-2); (M+H)+	757333	Peak area	Case	N	Exemestane	White	Baseline	N	N
Reversed phase POSITIVE ION MODE	CAFFEINE (CAS# 58-08-2); (M+H)+	766695	Peak area	Case	N	Exemestane	White	3 Month	Y	N
Reversed phase POSITIVE ION MODE	CAFFEINE (CAS# 58-08-2); (M+H)+	880437	Peak area	Case	Y	Exemestane	White	3 Month	Y	Y
Reversed phase POSITIVE ION MODE	CAFFEINE (CAS# 58-08-2); (M+H)+	887160	Peak area	Case	N	Exemestane	Black	Baseline	N	N
Reversed phase POSITIVE ION MODE	CAFFEINE (CAS# 58-08-2); (M+H)+	888698	Peak area	Control	N	Exemestane	White	3 Month	N	N
Reversed phase POSITIVE ION MODE	CAFFEINE (CAS# 58-08-2); (M+H)+	940130	Peak area	Control	Y	Letrozole	White	Baseline	Y	Y
Reversed phase POSITIVE ION MODE	CAFFEINE (CAS# 58-08-2); (M+H)+	1104606	Peak area	Control	N	Exemestane	White	Baseline	N	N
Reversed phase POSITIVE ION MODE	CAFFEINE (CAS# 58-08-2); (M+H)+	1168398	Peak area	Control	N	Letrozole	White	3 Month	N	N
Reversed phase POSITIVE ION MODE	CAFFEINE (CAS# 58-08-2); (M+H)+	1214310	Peak area	Case	Y	Exemestane	White	Baseline	N	Y
Reversed phase POSITIVE ION MODE	CAFFEINE (CAS# 58-08-2); (M+H)+	1232515	Peak area	Case	N	Letrozole	White	3 Month	N	N
Reversed phase POSITIVE ION MODE	CAFFEINE (CAS# 58-08-2); (M+H)+	1323937	Peak area	Case	N	Exemestane	White	Baseline	N	N
Reversed phase POSITIVE ION MODE	CAFFEINE (CAS# 58-08-2); (M+H)+	1342793	Peak area	Control	N	Letrozole	White	Baseline	Y	N
Reversed phase POSITIVE ION MODE	CAFFEINE (CAS# 58-08-2); (M+H)+	1349169	Peak area	Case	Y	Exemestane	White	Baseline	Y	N
Reversed phase POSITIVE ION MODE	CAFFEINE (CAS# 58-08-2); (M+H)+	1361597	Peak area	Control	N	Exemestane	White	3 Month	N	N
Reversed phase POSITIVE ION MODE	CAFFEINE (CAS# 58-08-2); (M+H)+	1413166	Peak area	Control	Y	Exemestane	White	Baseline	N	N
Reversed phase POSITIVE ION MODE	CAFFEINE (CAS# 58-08-2); (M+H)+	1428477	Peak area	Case	N	Exemestane	Black	3 Month	N	N
Reversed phase POSITIVE ION MODE	CAFFEINE (CAS# 58-08-2); (M+H)+	1456679	Peak area	Control	Y	Exemestane	White	Baseline	Y	N
Reversed phase POSITIVE ION MODE	CAFFEINE (CAS# 58-08-2); (M+H)+	1581236	Peak area	Case	Y	Exemestane	White	3 Month	N	Y
Reversed phase POSITIVE ION MODE	CAFFEINE (CAS# 58-08-2); (M+H)+	1706446	Peak area	Control	N	Letrozole	White	Baseline	N	N
Reversed phase POSITIVE ION MODE	CAFFEINE (CAS# 58-08-2); (M+H)+	1776782	Peak area	Case	N	Letrozole	White	Baseline	Y	N
Reversed phase POSITIVE ION MODE	CAFFEINE (CAS# 58-08-2); (M+H)+	1827044	Peak area	Control	N	Exemestane	White	3 Month	Y	N
Reversed phase POSITIVE ION MODE	CAFFEINE (CAS# 58-08-2); (M+H)+	1849640	Peak area	Control	Y	Exemestane	White	3 Month	N	N
Reversed phase POSITIVE ION MODE	CAFFEINE (CAS# 58-08-2); (M+H)+	2114513	Peak area	Case	N	Exemestane	White	3 Month	N	N
Reversed phase POSITIVE ION MODE	CAFFEINE (CAS# 58-08-2); (M+H)+	2194224	Peak area	Control	N	Exemestane	Black	3 Month	Y	N
Reversed phase POSITIVE ION MODE	CAFFEINE (CAS# 58-08-2); (M+H)+	2544227	Peak area	Control	N	Exemestane	White	3 Month	N	N
Reversed phase POSITIVE ION MODE	CAFFEINE (CAS# 58-08-2); (M+H)+	2555268	Peak area	Control	N	Letrozole	White	3 Month	N	N
Reversed phase POSITIVE ION MODE	CAFFEINE (CAS# 58-08-2); (M+H)+	2569067	Peak area	Case	N	Exemestane	White	3 Month	N	N
Reversed phase POSITIVE ION MODE	CAFFEINE (CAS# 58-08-2); (M+H)+	3113590	Peak area	Control	N	Letrozole	White	Baseline	N	N
Reversed phase POSITIVE ION MODE	CAFFEINE (CAS# 58-08-2); (M+H)+	3383721	Peak area	Case	N	Exemestane	White	3 Month	Y	N
Reversed phase POSITIVE ION MODE	CAFFEINE (CAS# 58-08-2); (M+H)+	3464402	Peak area	Case	N	Exemestane	White	Baseline	Y	N
Reversed phase POSITIVE ION MODE	CAFFEINE (CAS# 58-08-2); (M+H)+	3497673	Peak area	Case	N	Letrozole	White	3 Month	Y	N
Reversed phase POSITIVE ION MODE	CAFFEINE (CAS# 58-08-2); (M+H)+		Peak area	Case	N	Exemestane	White	3 Month	N	N
Reversed phase POSITIVE ION MODE	CAFFEINE (CAS# 58-08-2); (M+H)+		Peak area	Case	N	Letrozole	White	3 Month	Y	N
Reversed phase POSITIVE ION MODE	CAFFEINE (CAS# 58-08-2); (M+H)+		Peak area	Case	N	Letrozole	White	Baseline	Y	N
Reversed phase POSITIVE ION MODE	CAFFEINE (CAS# 58-08-2); (M+H)+		Peak area	Case	Y	Letrozole	White	3 Month	Y	Y
Reversed phase POSITIVE ION MODE	CAFFEINE (CAS# 58-08-2); (M+H)+		Peak area	Control	N	Exemestane	White	Baseline	N	N
Reversed phase POSITIVE ION MODE	CAFFEINE (CAS# 58-08-2); (M+H)+		Peak area	Control	N	Letrozole	Black	3 Month	N	N
Reversed phase POSITIVE ION MODE	CAFFEINE (CAS# 58-08-2); (M+H)+		Peak area	Control	N	Letrozole	White	3 Month	Y	N
Reversed phase POSITIVE ION MODE	CAFFEINE (CAS# 58-08-2); (M+H)+		Peak area	Control	Y	Exemestane	White	3 Month	Y	N
Reversed phase POSITIVE ION MODE	CAFFEINE (CAS# 58-08-2); (M+NA)+	1094	Peak area	Case	Y	Exemestane	White	3 Month	Y	Y
Reversed phase POSITIVE ION MODE	CAFFEINE (CAS# 58-08-2); (M+NA)+	1591	Peak area	Control	N	Letrozole	White	3 Month	N	N
Reversed phase POSITIVE ION MODE	CAFFEINE (CAS# 58-08-2); (M+NA)+	2406	Peak area	Control	Y	Exemestane	White	Baseline	N	Y
Reversed phase POSITIVE ION MODE	CAFFEINE (CAS# 58-08-2); (M+NA)+	4074	Peak area	Control	Y	Exemestane	White	3 Month	Y	N
Reversed phase POSITIVE ION MODE	CAFFEINE (CAS# 58-08-2); (M+NA)+	4241	Peak area	Case	Y	Exemestane	White	Baseline	Y	Y
Reversed phase POSITIVE ION MODE	CAFFEINE (CAS# 58-08-2); (M+NA)+	4321	Peak area	Control	Y	Exemestane	White	Baseline	N	N
Reversed phase POSITIVE ION MODE	CAFFEINE (CAS# 58-08-2); (M+NA)+	4437	Peak area	Case	Y	Exemestane	White	3 Month	Y	N
Reversed phase POSITIVE ION MODE	CAFFEINE (CAS# 58-08-2); (M+NA)+	4835	Peak area	Control	N	Letrozole	White	Baseline	Y	N
Reversed phase POSITIVE ION MODE	CAFFEINE (CAS# 58-08-2); (M+NA)+	5514	Peak area	Case	N	Exemestane	White	Baseline	N	N
Reversed phase POSITIVE ION MODE	CAFFEINE (CAS# 58-08-2); (M+NA)+	5516	Peak area	Case	N	Exemestane	White	3 Month	Y	N
Reversed phase POSITIVE ION MODE	CAFFEINE (CAS# 58-08-2); (M+NA)+	7308	Peak area	Control	Y	Letrozole	White	Baseline	Y	Y
Reversed phase POSITIVE ION MODE	CAFFEINE (CAS# 58-08-2); (M+NA)+	8001	Peak area	Case	Y	Exemestane	White	Baseline	N	Y
Reversed phase POSITIVE ION MODE	CAFFEINE (CAS# 58-08-2); (M+NA)+	8880	Peak area	Control	N	Letrozole	White	3 Month	N	N
Reversed phase POSITIVE ION MODE	CAFFEINE (CAS# 58-08-2); (M+NA)+	9249	Peak area	Case	Y	Exemestane	White	Baseline	Y	N
Reversed phase POSITIVE ION MODE	CAFFEINE (CAS# 58-08-2); (M+NA)+	9319	Peak area	Case	N	Letrozole	White	3 Month	N	N
Reversed phase POSITIVE ION MODE	CAFFEINE (CAS# 58-08-2); (M+NA)+	9998	Peak area	Case	N	Exemestane	White	Baseline	N	N
Reversed phase POSITIVE ION MODE	CAFFEINE (CAS# 58-08-2); (M+NA)+	10322	Peak area	Control	N	Letrozole	White	Baseline	N	N
Reversed phase POSITIVE ION MODE	CAFFEINE (CAS# 58-08-2); (M+NA)+	11127	Peak area	Control	N	Exemestane	White	3 Month	Y	N
Reversed phase POSITIVE ION MODE	CAFFEINE (CAS# 58-08-2); (M+NA)+	11607	Peak area	Case	Y	Exemestane	White	3 Month	N	Y
Reversed phase POSITIVE ION MODE	CAFFEINE (CAS# 58-08-2); (M+NA)+	14383	Peak area	Control	Y	Exemestane	White	3 Month	N	N
Reversed phase POSITIVE ION MODE	CAFFEINE (CAS# 58-08-2); (M+NA)+	14590	Peak area	Case	N	Exemestane	White	3 Month	N	N
Reversed phase POSITIVE ION MODE	CAFFEINE (CAS# 58-08-2); (M+NA)+	14973	Peak area	Control	N	Exemestane	Black	3 Month	Y	N
Reversed phase POSITIVE ION MODE	CAFFEINE (CAS# 58-08-2); (M+NA)+	15932	Peak area	Control	N	Exemestane	White	3 Month	N	N
Reversed phase POSITIVE ION MODE	CAFFEINE (CAS# 58-08-2); (M+NA)+	16408	Peak area	Case	N	Exemestane	White	3 Month	N	N
Reversed phase POSITIVE ION MODE	CAFFEINE (CAS# 58-08-2); (M+NA)+	17351	Peak area	Control	N	Letrozole	White	3 Month	N	N
Reversed phase POSITIVE ION MODE	CAFFEINE (CAS# 58-08-2); (M+NA)+	18944	Peak area	Control	N	Letrozole	White	Baseline	N	N
Reversed phase POSITIVE ION MODE	CAFFEINE (CAS# 58-08-2); (M+NA)+	19013	Peak area	Case	N	Exemestane	White	Baseline	Y	N
Reversed phase POSITIVE ION MODE	CAFFEINE (CAS# 58-08-2); (M+NA)+	20586	Peak area	Case	N	Exemestane	White	3 Month	Y	N
Reversed phase POSITIVE ION MODE	CAFFEINE (CAS# 58-08-2); (M+NA)+	20825	Peak area	Case	N	Letrozole	White	3 Month	Y	N
Reversed phase POSITIVE ION MODE	CAFFEINE (CAS# 58-08-2); (M+NA)+		Peak area	Case	N	Exemestane	Black	3 Month	N	N
Reversed phase POSITIVE ION MODE	CAFFEINE (CAS# 58-08-2); (M+NA)+		Peak area	Case	N	Exemestane	Black	Baseline	N	N
Reversed phase POSITIVE ION MODE	CAFFEINE (CAS# 58-08-2); (M+NA)+		Peak area	Case	N	Exemestane	White	3 Month	N	N
Reversed phase POSITIVE ION MODE	CAFFEINE (CAS# 58-08-2); (M+NA)+		Peak area	Case	N	Exemestane	White	3 Month	Y	N
Reversed phase POSITIVE ION MODE	CAFFEINE (CAS# 58-08-2); (M+NA)+		Peak area	Case	N	Exemestane	White	Baseline	N	N
Reversed phase POSITIVE ION MODE	CAFFEINE (CAS# 58-08-2); (M+NA)+		Peak area	Case	N	Exemestane	White	Baseline	Y	N
Reversed phase POSITIVE ION MODE	CAFFEINE (CAS# 58-08-2); (M+NA)+		Peak area	Case	N	Letrozole	Black	3 Month	N	N
Reversed phase POSITIVE ION MODE	CAFFEINE (CAS# 58-08-2); (M+NA)+		Peak area	Case	N	Letrozole	Black	Baseline	N	N
Reversed phase POSITIVE ION MODE	CAFFEINE (CAS# 58-08-2); (M+NA)+		Peak area	Case	N	Letrozole	White	3 Month	N	N
Reversed phase POSITIVE ION MODE	CAFFEINE (CAS# 58-08-2); (M+NA)+		Peak area	Case	N	Letrozole	White	3 Month	Y	N
Reversed phase POSITIVE ION MODE	CAFFEINE (CAS# 58-08-2); (M+NA)+		Peak area	Case	N	Letrozole	White	Baseline	N	N
Reversed phase POSITIVE ION MODE	CAFFEINE (CAS# 58-08-2); (M+NA)+		Peak area	Case	N	Letrozole	White	Baseline	Y	N
Reversed phase POSITIVE ION MODE	CAFFEINE (CAS# 58-08-2); (M+NA)+		Peak area	Case	Y	Exemestane	Black	3 Month	N	Y
Reversed phase POSITIVE ION MODE	CAFFEINE (CAS# 58-08-2); (M+NA)+		Peak area	Case	Y	Exemestane	Black	Baseline	N	Y
Reversed phase POSITIVE ION MODE	CAFFEINE (CAS# 58-08-2); (M+NA)+		Peak area	Case	Y	Exemestane	White	3 Month	N	Y
Reversed phase POSITIVE ION MODE	CAFFEINE (CAS# 58-08-2); (M+NA)+		Peak area	Case	Y	Exemestane	White	3 Month	Y	N
Reversed phase POSITIVE ION MODE	CAFFEINE (CAS# 58-08-2); (M+NA)+		Peak area	Case	Y	Exemestane	White	3 Month	Y	Y
Reversed phase POSITIVE ION MODE	CAFFEINE (CAS# 58-08-2); (M+NA)+		Peak area	Case	Y	Exemestane	White	Baseline	N	Y
Reversed phase POSITIVE ION MODE	CAFFEINE (CAS# 58-08-2); (M+NA)+		Peak area	Case	Y	Exemestane	White	Baseline	Y	N
Reversed phase POSITIVE ION MODE	CAFFEINE (CAS# 58-08-2); (M+NA)+		Peak area	Case	Y	Exemestane	White	Baseline	Y	Y
Reversed phase POSITIVE ION MODE	CAFFEINE (CAS# 58-08-2); (M+NA)+		Peak area	Case	Y	Letrozole	White	3 Month	Y	Y
Reversed phase POSITIVE ION MODE	CAFFEINE (CAS# 58-08-2); (M+NA)+		Peak area	Case	Y	Letrozole	White	Baseline	Y	Y
Reversed phase POSITIVE ION MODE	CAFFEINE (CAS# 58-08-2); (M+NA)+		Peak area	Control	N	Exemestane	Black	Baseline	Y	N
Reversed phase POSITIVE ION MODE	CAFFEINE (CAS# 58-08-2); (M+NA)+		Peak area	Control	N	Exemestane	White	3 Month	N	N
Reversed phase POSITIVE ION MODE	CAFFEINE (CAS# 58-08-2); (M+NA)+		Peak area	Control	N	Exemestane	White	Baseline	N	N
Reversed phase POSITIVE ION MODE	CAFFEINE (CAS# 58-08-2); (M+NA)+		Peak area	Control	N	Exemestane	White	Baseline	Y	N
Reversed phase POSITIVE ION MODE	CAFFEINE (CAS# 58-08-2); (M+NA)+		Peak area	Control	N	Letrozole	Black	3 Month	N	N
Reversed phase POSITIVE ION MODE	CAFFEINE (CAS# 58-08-2); (M+NA)+		Peak area	Control	N	Letrozole	Black	Baseline	N	N
Reversed phase POSITIVE ION MODE	CAFFEINE (CAS# 58-08-2); (M+NA)+		Peak area	Control	N	Letrozole	White	3 Month	Y	N
Reversed phase POSITIVE ION MODE	CAFFEINE (CAS# 58-08-2); (M+NA)+		Peak area	Control	N	Letrozole	White	Baseline	N	N
Reversed phase POSITIVE ION MODE	CAFFEINE (CAS# 58-08-2); (M+NA)+		Peak area	Control	N	Letrozole	White	Baseline	Y	N
Reversed phase POSITIVE ION MODE	CAFFEINE (CAS# 58-08-2); (M+NA)+		Peak area	Control	Y	Exemestane	White	3 Month	N	N
Reversed phase POSITIVE ION MODE	CAFFEINE (CAS# 58-08-2); (M+NA)+		Peak area	Control	Y	Exemestane	White	3 Month	N	Y
Reversed phase POSITIVE ION MODE	CAFFEINE (CAS# 58-08-2); (M+NA)+		Peak area	Control	Y	Exemestane	White	3 Month	Y	N
Reversed phase POSITIVE ION MODE	CAFFEINE (CAS# 58-08-2); (M+NA)+		Peak area	Control	Y	Exemestane	White	3 Month	Y	Y
Reversed phase POSITIVE ION MODE	CAFFEINE (CAS# 58-08-2); (M+NA)+		Peak area	Control	Y	Exemestane	White	Baseline	N	N
Reversed phase POSITIVE ION MODE	CAFFEINE (CAS# 58-08-2); (M+NA)+		Peak area	Control	Y	Exemestane	White	Baseline	N	Y
Reversed phase POSITIVE ION MODE	CAFFEINE (CAS# 58-08-2); (M+NA)+		Peak area	Control	Y	Exemestane	White	Baseline	Y	N
Reversed phase POSITIVE ION MODE	CAFFEINE (CAS# 58-08-2); (M+NA)+		Peak area	Control	Y	Exemestane	White	Baseline	Y	Y
Reversed phase POSITIVE ION MODE	CAFFEINE (CAS# 58-08-2); (M+NA)+		Peak area	Control	Y	Letrozole	White	3 Month	Y	N
Reversed phase POSITIVE ION MODE	CAFFEINE (CAS# 58-08-2); (M+NA)+		Peak area	Control	Y	Letrozole	White	3 Month	Y	Y
Reversed phase POSITIVE ION MODE	CAFFEINE (CAS# 58-08-2); (M+NA)+		Peak area	Control	Y	Letrozole	White	Baseline	Y	N
Reversed phase POSITIVE ION MODE	CAFFEINE (CAS# 58-08-2); (M+NA)+		Peak area	Control	Y	Letrozole	White	Baseline	Y	Y