Spectrum Details
FooDB ID:FDB029455
Compound name:PC(o-22:2(13Z,16Z)/22:2(13Z,16Z))
Spectrum type:Predicted LC-MS/MS Spectrum - 10V, Negative
Splash Key:splash10-004r-0007000290-46109b57eace9c21f25f
Notes:This is a predicted spectrum and it should only be used as a guide, further evidence is required to confirm identification.
Spectrum View
Experimental Conditions
Ionization Mode:Negative
Collision Energy:10 eV
Instrument Type:QTOF (generic), spectrum predicted by CFM-ID
Mass Resolution:0.0001 Da
Molecular Formula:C52H98NO7P
Molecular Weight (Monoisotopic Mass):879.7081 Da
Documentation
Document DescriptionDownload
List of m/z values for the spectrum (TXT)Download file287 Bytes
Generated list of m/z values for the spectrum (TXT-20190109-20465-XAQUVU)Download file287 Bytes
mzML formatted file (MZML)Download file4.17 KB
References
  1. Allen F, Greiner R, Wishart D: Competitive fragmentation modeling of ESI-MS/MS spectra for putative metabolite identification. Metabolomics. 2015 11(1):98–110. doi: 10.1007/s11306-014-0676-4.