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MB Sample ID: SA185578

Local Sample ID:Pooled Human Plasma 7
Subject ID:SU002061
Subject Type:Human
Subject Species:Homo sapiens
Taxonomy ID:9606
Gender:Pooled

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Combined analysis:

Analysis ID AN002856
Analysis type MS
Chromatography type HILIC
Chromatography system Agilent 1290 Infinity II
Column Waters Acquity BEH Amide (100 x 2.1mm,1.7um)
MS Type ESI
MS instrument type QTOF
MS instrument name Agilent 6545
Ion Mode POSITIVE
Units Total Intensity Units

MS:

MS ID:MS003005
Analysis ID:AN002856
Instrument Name:Agilent 6545
Instrument Type:QTOF
MS Type:ESI
MS Comments:Instrument settings for positive ionization mode following electrospray ionization were as follows: Sheath gas flow rate, 11 L/min; Drying gas, 8 L/min; Drying gas temperature, 320 ºC; Nebulizer, 35 psi; Capillary voltage, 3500 V; Nozzle voltage, 1000 V; Fragmentor, 175 V; Skimmer, 65 V; Octupole 1 RF Vpp, 750 V; Collision energy, 20; Iterative MS/MS mass error tolerance, ± 20 ppm; Iterative MS/MS retention time exclusion tolerance, ± 0.5 min; Spectrum data type, centroid. Data de-pendent MS/MS parameters: Mass range, 25-1200 m/z; Rate, 2 spectra/s; Max precursor ions per cycle, 3; Absolute precursor threshold, 5000 counts; Relative precursor threshold, 0.001%; Active exclusion enabled after 2 spectra and released after 0.5 min; Isolation width, narrow (~1.3 m/z). Iterative LC-MS/MS data acquired from the modified HILIC separation conditions was loaded into a pre-release version of an in-house software tool, MetIDTracker for feature detection. This software uses MSPepSearch (NIST) for database searching and score assignment.
Ion Mode:POSITIVE
Capillary Voltage:3500 V
Collision Energy:20
Collision Gas:N2
Dry Gas Flow:8L/min
Dry Gas Temp:320 C
Fragment Voltage:175 V
Fragmentation Method:CID
Ionization:ESI
Mass Accuracy:<20 ppm
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