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MB Sample ID: SA308869

Local Sample ID:DS1-123-047
Subject ID:SU002970
Subject Type:Human
Subject Species:Homo sapiens
Taxonomy ID:9606
Gender:Male and female

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Combined analysis:

Analysis ID AN004684 AN004685 AN004686 AN004687 AN004688
Analysis type MS MS MS MS MS
Chromatography type Reversed phase Reversed phase Reversed phase Reversed phase Reversed phase
Chromatography system Thermo Vanquish Thermo Vanquish Thermo Vanquish Thermo Vanquish Thermo Vanquish
Column Phenomenex Kinetex C18 (150 x 2.1mm,1.7um) Phenomenex Kinetex C18 (150 x 2.1mm,1.7um) Phenomenex Kinetex C18 (30 x 2.1mm, 1.7um) Phenomenex Kinetex C18 (30 x 2.1mm, 1.7um) Waters ACQUITY UPLC BEH C18 (100 x 2.1mm,1.7um)
MS Type ESI ESI ESI ESI EI
MS instrument type Orbitrap Orbitrap Orbitrap Orbitrap Orbitrap
MS instrument name Thermo Orbitrap Exploris 120 Thermo Orbitrap Exploris 120 Thermo Q Exactive Orbitrap Thermo Q Exactive Orbitrap Thermo Q Exactive Orbitrap
Ion Mode POSITIVE NEGATIVE POSITIVE NEGATIVE NEGATIVE
Units Peak area Peak area Peak area Peak area Peak area

Chromatography:

Chromatography ID:CH003526
Chromatography Summary:Metabolomics Positive
Instrument Name:Thermo Vanquish
Column Name:Phenomenex Kinetex C18 (150 x 2.1mm,1.7um)
Column Temperature:45
Flow Gradient:0 min - 0.45 ml/min - 5% B, 0.5 min - 0.45ml/min - 5% B, 1.1 min - 0.45ml/min - 95% B, 2.75 min - 0.45ml/min - 95% B, 3 min - 0.45ml/min - 5% B, 5min - 0.45ml/min - 5%B
Flow Rate:0.45 ml/min
Solvent A:0.1% Formic Acid in Water
Solvent B:0.1% Formic Acid in ACN
Chromatography Type:Reversed phase
  
Chromatography ID:CH003527
Chromatography Summary:Metabolomics Negative
Instrument Name:Thermo Vanquish
Column Name:Phenomenex Kinetex C18 (150 x 2.1mm,1.7um)
Column Temperature:45
Flow Gradient:0 min - 0.45 ml/min - 0% B, 0.5 min - 0.45ml/min - 0% B, 1.1 min - 0.45ml/min - 100% B, 2.75 min - 0.45ml/min - 100% B, 3 min - 0.45ml/min - 0% B, 5min - 0.45ml/min - 0%B
Flow Rate:0.45 ml/min
Solvent A:5% ACN 95% Water 1mM Ammonium Acetate
Solvent B:95% ACN 5% Water 1mM Ammonium Acetate
Chromatography Type:Reversed phase
  
Chromatography ID:CH003528
Chromatography Summary:Lipidomics Positive
Instrument Name:Thermo Vanquish
Column Name:Phenomenex Kinetex C18 (30 x 2.1mm, 1.7um)
Column Temperature:50
Flow Gradient:0 min - 0.3ml/min - 30%B, 3 min - 0.3ml/min - 100%B, 4.2min - 0.3ml/min - 100%B, 4.3min - 0.4ml/min - 30%B, 4.9min - 0/4ml/min - 30%B, 5 min - 0.3ml/min 30%B
Flow Rate:0.3-0.4ml/min
Solvent A:75:25 H2O:ACN 5mM NH4OAc
Solvent B:90:10 iPrOH:ACN 5mM NH4OAc
Chromatography Type:Reversed phase
  
Chromatography ID:CH003529
Chromatography Summary:Lipidomics Negative
Instrument Name:Thermo Vanquish
Column Name:Phenomenex Kinetex C18 (30 x 2.1mm, 1.7um)
Column Temperature:50
Flow Gradient:0 min - 0.3ml/min - 10%B, 3 min - 0.3ml/min - 95%B, 4.2min - 0.3ml/min - 95%B, 4.3min - 0.45ml/min - 10%B, 4.9min - 0.4ml/min - 10%B, 5 min - 0.3ml/min 10%B
Flow Rate:0.3-0.45ml/min
Solvent A:75:25 H2O:ACN 5mM NH4OAc
Solvent B:90:10 iPrOH:ACN 5mM NH4OAc
Chromatography Type:Reversed phase
  
Chromatography ID:CH003530
Chromatography Summary:Oxylipin Negative
Instrument Name:Thermo Vanquish
Column Name:Waters ACQUITY UPLC BEH C18 (100 x 2.1mm,1.7um)
Column Temperature:60
Flow Gradient:0min - 0.35ml/min - 0%B, 0.5min - 0.35ml/min - 25%B, 1min - 0.35ml/min - 25%B, 2.5min - 0.35ml/min - 40%B, 2.6min -0.35ml/min - 55%B, 4.5min - 0.35ml/min - 70%B, 4.6min - 0.35ml/min - 100%B, 6min - 0.35ml/min - 100%B, 6.1min - 0.35ml/min - 0%B, 7min - 0.35ml/min 0%B
Flow Rate:0.35ml/min
Solvent A:20:80:0.02 ACN:Water:Formic Acid
Solvent B:20:80:0.02 ACN:IPA:Formic Acid
Chromatography Type:Reversed phase
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