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MB Sample ID: SA227356
| Local Sample ID: | HCO72 |
| Subject ID: | SU002406 |
| Subject Type: | Human |
| Subject Species: | Homo sapiens |
| Taxonomy ID: | 9606 |
| Age Or Age Range: | 5-77 |
| Weight Or Weight Range: | NA |
| Height Or Height Range: | NA |
| Gender: | Male and female |
| Human Lifestyle Factors: | Urban industrial; Rural industrial; Rural traditional; Isolated traditional |
| Human Alcohol Drug Use: | NA |
| Human Nutrition: | NA |
| Human Inclusion Criteria: | NA |
| Human Exclusion Criteria: | NA |
Select appropriate tab below to view additional metadata details:
Combined analysis:
| Analysis ID | AN003787 |
|---|---|
| Analysis type | MS |
| Chromatography type | Reversed phase |
| Chromatography system | ThermoFisher Scientific Vanquish Flex Binary LC System |
| Column | Kinetex C18 core-shell (50 x 2.1mm,1.7um,100Å) |
| MS Type | ESI |
| MS instrument type | Triple quadrupole |
| MS instrument name | Thermo Q Exactive Plus Orbitrap |
| Ion Mode | POSITIVE |
| Units | Peak area |
MS:
| MS ID: | MS003530 |
| Analysis ID: | AN003787 |
| Instrument Name: | Thermo Q Exactive Plus Orbitrap |
| Instrument Type: | Triple quadrupole |
| MS Type: | ESI |
| MS Comments: | LC was performed on a ThermoFisher Scientific Vanquish Flex Binary LC System with a Kinetex C18 core-shell column (50 x 2.1 mm, 1.7 μM particle size, 100 Å pore size). LC column was kept at 40 °C and the sample compartment was held at 10 °C. The LC System was coupled to a ThermoFisher Scientific Q Exactive Plus Hybrid Quadrupole-Orbitrap Mass Spectrometer for MS/MS analysis. For the LC mobile phase, Solvent A was LC-MS grade water (Fisher Scientific) with 0.1% formic acid and Solvent B was LC-MS grade acetonitrile (Fisher Scientific) with 0.1% formic acid. Elution gradient started at 5% Solvent B for one minute, increased to 100% Solvent B until minute nine, held at 100% Solvent B for two minutes, dropped to 5% Solvent B over 30 seconds, and 5% Solvent B for one minute as re-equilibration. Samples were injected in random order with an injection volume of 5 μl. After elution, electrospray ionization was conducted with spray voltage of 3.8 kV, auxiliary gas flow rate of 10, auxiliary gas temperature at 350 °C, sheath gas flow rate at 35, and sweep gas flow at 0. Capillary temperature was 320 °C and S-lens RF was 50 V. MS1 scan range was 100-1,500 m/z, MS1 resolution was set to 35,000 and MS1 AGC target to 1e6. MS1 data were obtained in positive mode and MS2 data were obtained using data-dependent acquisition. In each cycle, 5 MS/MS scans of the most abundant ion were recorded. Both MS1 and MS2 injection times were set at 100 ms. MS2 resolutions were set to 17,500, MS2 AGC target was set to 5e5, and the inclusion window to 2 m/z. MS/MS was conducted at an apex trigger of 2-8 seconds and an exclusion window of 10 seconds. MS/MS collision energy gradually increased from 20-40%. |
| Ion Mode: | POSITIVE |
| Capillary Temperature: | 320°C |
| Ionization: | ESI |
| Analysis Protocol File: | C18_RP_Pos_QEPlus_20180403_12.5mint_ddMS2_MS.txt |
