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MB Sample ID: SA128467

Local Sample ID:S7
Subject ID:SU001599
Subject Type:Mammal
Subject Species:Mus musculus
Taxonomy ID:10090
Genotype Strain:C57BL/6
Age Or Age Range:8 weeks
Gender:Male and female
Animal Animal Supplier:Jackson Labs (Bar Harbor, ME USA)

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Combined analysis:

Analysis ID AN002546
Analysis type MS
Chromatography type Reversed phase
Chromatography system Thermo-Fisher LTQ Orbitrap Elite
Column Bruker Micron Magic nanoC18 (130mm X 100um,5um)
MS Type ESI
MS instrument type Orbitrap
MS instrument name Thermo Orbitrap Elite Hybrid Ion Trap-Orbitrap
Ion Mode POSITIVE
Units Normalized Peak Height

MS:

MS ID:MS002364
Analysis ID:AN002546
Instrument Name:Thermo Orbitrap Elite Hybrid Ion Trap-Orbitrap
Instrument Type:Orbitrap
MS Type:ESI
MS Comments:Lipid structures were identified based on the retention time and subsequent MS/MS spectra. Essentially, we determined structural information through LC-MS/MS and normalization of available lipid standards using LipidMatch. First, lipidomics data processed lipid features using MZmine as described in (Koelmel et al. 2017). Features observed in the blanks were removed using the blank feature filtration method (Patterson et al. 2017). The blank feature filtration method compared to various other filtering methods has been shown to increase the removal of true negatives while decreasing the removal of true positives (Patterson et al. 2017). The resulting MZmine features were annotated using LipidMatch (Koelmel et al. 2017). These annotations are putative, as annotations are based on in-silico MS/MS spectral libraries without matching internal standards for validation and without confirmation using orthogonal approaches (Sumner et al. 2007). The lipid match program then provided a single point calibration using exogenous lipid internal calibrant that best represents the lipid feature (based on lipid class, adduct and retention time). An R script was applied that combined multiple lipid features (adducts) into one feature 4 representing a unique lipid molecule. All open source lipidomics tools are published and available at http://secim.ufl.edu/ secim-tools/.
Ion Mode:POSITIVE
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