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MB Sample ID: SA136751

Local Sample ID:Controlinvitro_6
Subject ID:SU001687
Subject Type:Cultured cells
Subject Species:Homo sapiens
Taxonomy ID:9606
Cell Strain Details:Human Lung epithelial A549 cancer cells

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Combined analysis:

Analysis ID AN002644
Analysis type MS
Chromatography type Reversed phase
Chromatography system Agilent 1290
Column Poroshell 120 SB-C18 (100 x 2.1mm,2.7um)
MS Type ESI
MS instrument type QTOF
MS instrument name Agilent 6545 QTOF
Ion Mode POSITIVE
Units Normalized abundances

Chromatography:

Chromatography ID:CH001953
Chromatography Summary:The entire LC/MS-MS experiment was performed in the Campus Chemical Instrumentation Center’s Mass Spectrometry and Proteomics facility at The Ohio State University. Lyophilized samples were dissolved in equal amounts of LC-MS grade water and acetonitrile and run with LC/MS-MS analysis, using an untargeted metabolomics approach by utilizing Agilent Q-TOF 6545 mass spectrometer connected to an Agilent 1290 UHPLC system with a Poroshell 120 SB-C18 (2 x 100 mm, 2.7 µm particle size) column. The LC gradient consisted of solvent A, H2O with 0.1 % Formic acid, and solvent B, 100 % acetonitrile at a 200 µL/min flow rate with an initial 2 % solvent B with a linear ramp to 95 % B at 15 min, holding at 95% B for 1 minutes, and back to 2 % B from 16 min and equilibration of 2 % B until min 32. A 5 µL volume sample was injected for each run and the top 5 ions were selected for data-dependent analysis with a 15 second exclusion window.
Instrument Name:Agilent 1290
Column Name:Poroshell 120 SB-C18 (100 x 2.1mm,2.7um)
Column Pressure:800 bar
Column Temperature:40
Flow Gradient:an initial 2 % solvent B with a linear ramp to 95 % B at 15 min, holding at 95% B for 1 minutes, and back to 2 % B from 16 min and equilibration of 2 % B until min 32.
Flow Rate:200 µL/min
Sample Injection:5 µL
Solvent A:100% water; 0.1% formic acid
Solvent B:100% acetonitrile
Capillary Voltage:500 V
Chromatography Type:Reversed phase
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