{
"METABOLOMICS WORKBENCH":{"STUDY_ID":"ST000763","ANALYSIS_ID":"AN001204","VERSION":"1","CREATED_ON":"July 4, 2017, 3:38 pm"},

"PROJECT":{"PROJECT_TITLE":"Untargeted and lipidomics_scleroderma_PAH","PROJECT_TYPE":"MS analysis","PROJECT_SUMMARY":"Untargeted/lipidomics analysis","INSTITUTE":"University of Michigan","DEPARTMENT":"Internal Medicine-Cardiology","LABORATORY":"Visovatti Lab","LAST_NAME":"Visovatti","FIRST_NAME":"Scott","ADDRESS":"Ann Arbor, MI","EMAIL":"shv@med.umich.edu","PHONE":"734-657-6917"},

"STUDY":{"STUDY_TITLE":"Untargeted metabolomics and lipidomics of scleroderma PAH discovery cohort","STUDY_TYPE":"MS analysis","STUDY_SUMMARY":"This experiment was performed using the following cohorts: 1) healthy controls, 2) patients with scleroderma at low risk for pulmonary hypertension, 3) pateints with scleroderma at high risk for pulmonary hypertension who underwent a catheterization and were found to have normal pressures, borderline elevated pressures or pulmonary arterial hypertensino (PAH). Whole blood was drawn directly into EDTA tubes at rest and again at peak exercise for each human subject. The samples were processed to plasma by MCRU and stored at -80 in the Biorepository.","INSTITUTE":"University of Michigan","DEPARTMENT":"Biomedical Research Core Facilities","LABORATORY":"Metabolomics core","LAST_NAME":"Kachman","FIRST_NAME":"Maureen","ADDRESS":"6300 Brehm Tower, 1000 Wall Street, Ann Arbor, MI 48105-5714","EMAIL":"mkachman@med.umich.edu","PHONE":"(734) 232-8175","NUM_GROUPS":"11","TOTAL_SUBJECTS":"5"},

"SUBJECT":{"SUBJECT_TYPE":"Human","SUBJECT_SPECIES":"Homo sapiens","TAXONOMY_ID":"9606"},
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"Sample ID":"S00021257",
"Factors":{"Exercise":"No","Group":"Borderline Pressures","Sex":"Female","Type":"Cath"}
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{
"Subject ID":"SU0014101",
"Sample ID":"S00021258",
"Factors":{"Exercise":"Yes","Group":"Borderline Pressures","Sex":"Female","Type":"Cath"}
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{
"Subject ID":"SU0014102",
"Sample ID":"S00021259",
"Factors":{"Exercise":"No","Group":"PAH","Sex":"Female","Type":"Cath"}
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{
"Subject ID":"SU0014102",
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"Factors":{"Exercise":"Yes","Group":"PAH","Sex":"Female","Type":"Cath"}
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"Factors":{"Exercise":"No","Group":"Normal Pressures","Sex":"Female","Type":"Cath"}
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"Factors":{"Exercise":"Yes","Group":"Borderline Pressures","Sex":"Female","Type":"Cath"}
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"Factors":{"Exercise":"No","Group":"Borderline Pressures","Sex":"Female","Type":"Cath"}
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{
"Subject ID":"SU0014101",
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{
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"Subject ID":"SU0014102",
"Sample ID":"S00021295",
"Factors":{"Exercise":"No","Group":"PAH","Sex":"Female","Type":"Cath"}
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"Sample ID":"S00021309",
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"Sample ID":"S00021310",
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"Factors":{"Exercise":"No","Group":"Healthy","Sex":"Female","Type":"Non-invasive"}
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"Factors":{"Exercise":"Yes","Group":"Healthy","Sex":"Female","Type":"Non-invasive"}
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"Factors":{"Exercise":"No","Group":"Healthy","Sex":"Female","Type":"Non-invasive"}
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"Sample ID":"S00021314",
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},
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"Subject ID":"SU0014105",
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},
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},
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"Factors":{"Exercise":"No","Group":"Borderline Pressures","Sex":"Female","Type":"Cath"}
},
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},
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{
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},
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"Subject ID":"SU0014105",
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"Factors":{"Exercise":"No","Group":"LowRisk","Sex":"Female","Type":"Non-invasive"}
},
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"Subject ID":"SU0014105",
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},
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"Factors":{"Exercise":"No","Group":"PAH","Sex":"Female","Type":"Cath"}
},
{
"Subject ID":"SU0014102",
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"Factors":{"Exercise":"Yes","Group":"PAH","Sex":"Female","Type":"Cath"}
},
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"Factors":{"Exercise":"No","Group":"PAH","Sex":"Female","Type":"Cath"}
},
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},
{
"Subject ID":"SU0014104",
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"Factors":{"Exercise":"Yes","Group":"Healthy","Sex":"Female","Type":"Non-invasive"}
},
{
"Subject ID":"SU0014104",
"Sample ID":"S00021389",
"Factors":{"Exercise":"No","Group":"Healthy","Sex":"Female","Type":"Non-invasive"}
},
{
"Subject ID":"SU0014104",
"Sample ID":"S00021390",
"Factors":{"Exercise":"Yes","Group":"Healthy","Sex":"Female","Type":"Non-invasive"}
},
{
"Subject ID":"SU0014104",
"Sample ID":"S00021391",
"Factors":{"Exercise":"No","Group":"Healthy","Sex":"Female","Type":"Non-invasive"}
},
{
"Subject ID":"SU0014104",
"Sample ID":"S00021392",
"Factors":{"Exercise":"Yes","Group":"Healthy","Sex":"Female","Type":"Non-invasive"}
},
{
"Subject ID":"SU0014105",
"Sample ID":"S00021393",
"Factors":{"Exercise":"No","Group":"LowRisk","Sex":"Female","Type":"Non-invasive"}
},
{
"Subject ID":"SU0014105",
"Sample ID":"S00021394",
"Factors":{"Exercise":"Yes","Group":"LowRisk","Sex":"Female","Type":"Non-invasive"}
},
{
"Subject ID":"SU0014105",
"Sample ID":"S00021395",
"Factors":{"Exercise":"No","Group":"LowRisk","Sex":"Female","Type":"Non-invasive"}
},
{
"Subject ID":"SU0014105",
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"Factors":{"Exercise":"Yes","Group":"LowRisk","Sex":"Female","Type":"Non-invasive"}
},
{
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},
{
"Subject ID":"SU0014104",
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},
{
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},
{
"Subject ID":"SU0014104",
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"Factors":{"Exercise":"Yes","Group":"Healthy","Sex":"Female","Type":"Non-invasive"}
},
{
"Subject ID":"SU0014104",
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},
{
"Subject ID":"SU0014104",
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},
{
"Subject ID":"SU0014104",
"Sample ID":"S00021403",
"Factors":{"Exercise":"No","Group":"Healthy","Sex":"Female","Type":"Non-invasive"}
},
{
"Subject ID":"SU0014104",
"Sample ID":"S00021404",
"Factors":{"Exercise":"Yes","Group":"Healthy","Sex":"Female","Type":"Non-invasive"}
},
{
"Subject ID":"SU0014105",
"Sample ID":"S00021405",
"Factors":{"Exercise":"No","Group":"LowRisk","Sex":"Male","Type":"Non-invasive"}
},
{
"Subject ID":"SU0014105",
"Sample ID":"S00021406",
"Factors":{"Exercise":"Yes","Group":"LowRisk","Sex":"Male","Type":"Non-invasive"}
},
{
"Subject ID":"SU0014102",
"Sample ID":"S00021407",
"Factors":{"Exercise":"No","Group":"PAH","Sex":"Female","Type":"Cath"}
},
{
"Subject ID":"SU0014102",
"Sample ID":"S00021408",
"Factors":{"Exercise":"Yes","Group":"PAH","Sex":"Female","Type":"Cath"}
},
{
"Subject ID":"SU0014103",
"Sample ID":"S00021409",
"Factors":{"Exercise":"No","Group":"Normal Pressures","Sex":"Female","Type":"Cath"}
},
{
"Subject ID":"SU0014103",
"Sample ID":"S00021410",
"Factors":{"Exercise":"Yes","Group":"Normal Pressures","Sex":"Female","Type":"Cath"}
},
{
"Subject ID":"SU0014101",
"Sample ID":"S00021411",
"Factors":{"Exercise":"No","Group":"Borderline Pressures","Sex":"Female","Type":"Cath"}
},
{
"Subject ID":"SU0014101",
"Sample ID":"S00021412",
"Factors":{"Exercise":"Yes","Group":"Borderline Pressures","Sex":"Female","Type":"Cath"}
},
{
"Subject ID":"SU0014105",
"Sample ID":"S00021413",
"Factors":{"Exercise":"No","Group":"LowRisk","Sex":"Female","Type":"Non-invasive"}
},
{
"Subject ID":"SU0014105",
"Sample ID":"S00021414",
"Factors":{"Exercise":"Yes","Group":"LowRisk","Sex":"Female","Type":"Non-invasive"}
},
{
"Subject ID":"SU0014104",
"Sample ID":"S00021415",
"Factors":{"Exercise":"No","Group":"Healthy","Sex":"Female","Type":"Non-invasive"}
},
{
"Subject ID":"SU0014104",
"Sample ID":"S00021416",
"Factors":{"Exercise":"Yes","Group":"Healthy","Sex":"Female","Type":"Non-invasive"}
},
{
"Subject ID":"SU0014102",
"Sample ID":"S00021417",
"Factors":{"Exercise":"No","Group":"PAH","Sex":"Male","Type":"Cath"}
},
{
"Subject ID":"SU0014102",
"Sample ID":"S00021418",
"Factors":{"Exercise":"Yes","Group":"PAH","Sex":"Male","Type":"Cath"}
},
{
"Subject ID":"SU0014102",
"Sample ID":"S00021419",
"Factors":{"Exercise":"No","Group":"PAH","Sex":"Female","Type":"Cath"}
},
{
"Subject ID":"SU0014102",
"Sample ID":"S00021420",
"Factors":{"Exercise":"Yes","Group":"PAH","Sex":"Female","Type":"Cath"}
},
{
"Subject ID":"SU0014103",
"Sample ID":"S00021421",
"Factors":{"Exercise":"No","Group":"Normal Pressures","Sex":"Female","Type":"Cath"}
},
{
"Subject ID":"SU0014103",
"Sample ID":"S00021422",
"Factors":{"Exercise":"Yes","Group":"Normal Pressures","Sex":"Female","Type":"Cath"}
},
{
"Subject ID":"SU0014104",
"Sample ID":"S00021423",
"Factors":{"Exercise":"No","Group":"Healthy","Sex":"Female","Type":"Non-invasive"}
},
{
"Subject ID":"SU0014104",
"Sample ID":"S00021424",
"Factors":{"Exercise":"Yes","Group":"Healthy","Sex":"Female","Type":"Non-invasive"}
},
{
"Subject ID":"SU0014104",
"Sample ID":"S00021425",
"Factors":{"Exercise":"No","Group":"Healthy","Sex":"Female","Type":"Non-invasive"}
},
{
"Subject ID":"SU0014104",
"Sample ID":"S00021426",
"Factors":{"Exercise":"Yes","Group":"Healthy","Sex":"Female","Type":"Non-invasive"}
},
{
"Subject ID":"SU0014104",
"Sample ID":"S00021427",
"Factors":{"Exercise":"No","Group":"Healthy","Sex":"Female","Type":"Non-invasive"}
},
{
"Subject ID":"SU0014104",
"Sample ID":"S00021428",
"Factors":{"Exercise":"Yes","Group":"Healthy","Sex":"Female","Type":"Non-invasive"}
},
{
"Subject ID":"SU0014104",
"Sample ID":"S00021429",
"Factors":{"Exercise":"No","Group":"Healthy","Sex":"Female","Type":"Non-invasive"}
},
{
"Subject ID":"SU0014104",
"Sample ID":"S00021430",
"Factors":{"Exercise":"Yes","Group":"Healthy","Sex":"Female","Type":"Non-invasive"}
},
{
"Subject ID":"SU0014105",
"Sample ID":"S00021431",
"Factors":{"Exercise":"No","Group":"LowRisk","Sex":"Female","Type":"Non-invasive"}
},
{
"Subject ID":"SU0014105",
"Sample ID":"S00021432",
"Factors":{"Exercise":"Yes","Group":"LowRisk","Sex":"Female","Type":"Non-invasive"}
},
{
"Subject ID":"SU0014105",
"Sample ID":"S00021433",
"Factors":{"Exercise":"No","Group":"LowRisk","Sex":"Female","Type":"Non-invasive"}
},
{
"Subject ID":"SU0014105",
"Sample ID":"S00021434",
"Factors":{"Exercise":"Yes","Group":"LowRisk","Sex":"Female","Type":"Non-invasive"}
},
{
"Subject ID":"SU0014104",
"Sample ID":"S00021435",
"Factors":{"Exercise":"No","Group":"Healthy","Sex":"Female","Type":"Non-invasive"}
},
{
"Subject ID":"SU0014104",
"Sample ID":"S00021436",
"Factors":{"Exercise":"Yes","Group":"Healthy","Sex":"Female","Type":"Non-invasive"}
},
{
"Subject ID":"SU0014104",
"Sample ID":"S00021437",
"Factors":{"Exercise":"No","Group":"Healthy","Sex":"Female","Type":"Non-invasive"}
},
{
"Subject ID":"SU0014104",
"Sample ID":"S00021438",
"Factors":{"Exercise":"Yes","Group":"Healthy","Sex":"Female","Type":"Non-invasive"}
},
{
"Subject ID":"SU0014102",
"Sample ID":"S00021439",
"Factors":{"Exercise":"No","Group":"PAH","Sex":"Female","Type":"Cath"}
},
{
"Subject ID":"SU0014102",
"Sample ID":"S00021440",
"Factors":{"Exercise":"Yes","Group":"PAH","Sex":"Female","Type":"Cath"}
},
{
"Subject ID":"SU0014105",
"Sample ID":"S00021441",
"Factors":{"Exercise":"No","Group":"LowRisk","Sex":"Female","Type":"Non-invasive"}
},
{
"Subject ID":"SU0014105",
"Sample ID":"S00021442",
"Factors":{"Exercise":"Yes","Group":"LowRisk","Sex":"Female","Type":"Non-invasive"}
},
{
"Subject ID":"SU0014102",
"Sample ID":"S00021443",
"Factors":{"Exercise":"No","Group":"PAH","Sex":"Female","Type":"Cath"}
},
{
"Subject ID":"SU0014102",
"Sample ID":"S00021444",
"Factors":{"Exercise":"Yes","Group":"PAH","Sex":"Female","Type":"Cath"}
},
{
"Subject ID":"SU0014105",
"Sample ID":"S00021445",
"Factors":{"Exercise":"No","Group":"LowRisk","Sex":"Female","Type":"Non-invasive"}
},
{
"Subject ID":"SU0014105",
"Sample ID":"S00021446",
"Factors":{"Exercise":"Yes","Group":"LowRisk","Sex":"Female","Type":"Non-invasive"}
},
{
"Subject ID":"SU0014101",
"Sample ID":"S00021447",
"Factors":{"Exercise":"No","Group":"Borderline Pressures","Sex":"Female","Type":"Cath"}
},
{
"Subject ID":"SU0014101",
"Sample ID":"S00021448",
"Factors":{"Exercise":"Yes","Group":"Borderline Pressures","Sex":"Female","Type":"Cath"}
},
{
"Subject ID":"SU0014101",
"Sample ID":"S00021449",
"Factors":{"Exercise":"No","Group":"Borderline Pressures","Sex":"Female","Type":"Cath"}
},
{
"Subject ID":"SU0014101",
"Sample ID":"S00021450",
"Factors":{"Exercise":"Yes","Group":"Borderline Pressures","Sex":"Female","Type":"Cath"}
},
{
"Subject ID":"SU0014102",
"Sample ID":"S00021451",
"Factors":{"Exercise":"No","Group":"PAH","Sex":"Female","Type":"Cath"}
},
{
"Subject ID":"SU0014102",
"Sample ID":"S00021452",
"Factors":{"Exercise":"Yes","Group":"PAH","Sex":"Female","Type":"Cath"}
},
{
"Subject ID":"SU0014101",
"Sample ID":"S00021453",
"Factors":{"Exercise":"No","Group":"Borderline Pressures","Sex":"Female","Type":"Cath"}
},
{
"Subject ID":"SU0014101",
"Sample ID":"S00021454",
"Factors":{"Exercise":"Yes","Group":"Borderline Pressures","Sex":"Female","Type":"Cath"}
},
{
"Subject ID":"SU0014105",
"Sample ID":"S00021455",
"Factors":{"Exercise":"No","Group":"LowRisk","Sex":"Female","Type":"Non-invasive"}
},
{
"Subject ID":"SU0014105",
"Sample ID":"S00021456",
"Factors":{"Exercise":"Yes","Group":"LowRisk","Sex":"Female","Type":"Non-invasive"}
},
{
"Subject ID":"SU0014105",
"Sample ID":"S00021457",
"Factors":{"Exercise":"No","Group":"LowRisk","Sex":"Female","Type":"Non-invasive"}
},
{
"Subject ID":"SU0014105",
"Sample ID":"S00021458",
"Factors":{"Exercise":"Yes","Group":"LowRisk","Sex":"Female","Type":"Non-invasive"}
},
{
"Subject ID":"SU0014105",
"Sample ID":"S00021459",
"Factors":{"Exercise":"No","Group":"LowRisk","Sex":"Female","Type":"Non-invasive"}
},
{
"Subject ID":"SU0014105",
"Sample ID":"S00021460",
"Factors":{"Exercise":"Yes","Group":"LowRisk","Sex":"Female","Type":"Non-invasive"}
},
{
"Subject ID":"SU0014105",
"Sample ID":"S00021461",
"Factors":{"Exercise":"No","Group":"LowRisk","Sex":"Female","Type":"Non-invasive"}
},
{
"Subject ID":"SU0014105",
"Sample ID":"S00021462",
"Factors":{"Exercise":"Yes","Group":"LowRisk","Sex":"Female","Type":"Non-invasive"}
},
{
"Subject ID":"SU0014102",
"Sample ID":"S00021463",
"Factors":{"Exercise":"No","Group":"PAH","Sex":"Female","Type":"Cath"}
},
{
"Subject ID":"SU0014102",
"Sample ID":"S00021464",
"Factors":{"Exercise":"Yes","Group":"PAH","Sex":"Female","Type":"Cath"}
},
{
"Subject ID":"SU0014105",
"Sample ID":"S00021465",
"Factors":{"Exercise":"No","Group":"LowRisk","Sex":"Female","Type":"Non-invasive"}
},
{
"Subject ID":"SU0014105",
"Sample ID":"S00021466",
"Factors":{"Exercise":"Yes","Group":"LowRisk","Sex":"Female","Type":"Non-invasive"}
},
{
"Subject ID":"SU0014105",
"Sample ID":"S00021467",
"Factors":{"Exercise":"No","Group":"LowRisk","Sex":"Female","Type":"Non-invasive"}
},
{
"Subject ID":"SU0014105",
"Sample ID":"S00021468",
"Factors":{"Exercise":"Yes","Group":"LowRisk","Sex":"Female","Type":"Non-invasive"}
},
{
"Subject ID":"SU0014104",
"Sample ID":"S00021469",
"Factors":{"Exercise":"No","Group":"Healthy","Sex":"Female","Type":"Non-invasive"}
},
{
"Subject ID":"SU0014104",
"Sample ID":"S00021470",
"Factors":{"Exercise":"Yes","Group":"Healthy","Sex":"Female","Type":"Non-invasive"}
},
{
"Subject ID":"SU0014105",
"Sample ID":"S00021471",
"Factors":{"Exercise":"No","Group":"LowRisk","Sex":"Female","Type":"Non-invasive"}
},
{
"Subject ID":"SU0014105",
"Sample ID":"S00021472",
"Factors":{"Exercise":"Yes","Group":"LowRisk","Sex":"Female","Type":"Non-invasive"}
},
{
"Subject ID":"SU0014105",
"Sample ID":"S00021473",
"Factors":{"Exercise":"No","Group":"LowRisk","Sex":"Male","Type":"Non-invasive"}
},
{
"Subject ID":"SU0014105",
"Sample ID":"S00021474",
"Factors":{"Exercise":"Yes","Group":"LowRisk","Sex":"Male","Type":"Non-invasive"}
}
],
"COLLECTION":{"COLLECTION_SUMMARY":"-"},

"TREATMENT":{"TREATMENT_SUMMARY":"-"},

"SAMPLEPREP":{"SAMPLEPREP_SUMMARY":"-","SAMPLEPREP_PROTOCOL_FILENAME":"A003 - Untargeted Metabolomics.pdf"},

"CHROMATOGRAPHY":{"CHROMATOGRAPHY_TYPE":"Reversed phase","INSTRUMENT_NAME":"ABI Sciex 5600+ TripleTOF","COLUMN_NAME":"Waters Acquity HSS T3 (50 x 2.1mm, 1.8um)"},

"ANALYSIS":{"ANALYSIS_TYPE":"MS","ANALYSIS_PROTOCOL_FILE":"A004 - Shotgun Lipidomics.pdf"},

"MS":{"MS_COMMENTS":"-","INSTRUMENT_NAME":"ABI Sciex 5600+ TripleTOF","INSTRUMENT_TYPE":"Triple TOF","MS_TYPE":"ESI","ION_MODE":"POSITIVE"},

"MS_METABOLITE_DATA":{
"Units":"peak area normalized",

"Data":[{"Metabolite":"CE(16:0); 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}

}