Spectrum Details
BMDB ID:BMDB0008146
Compound name:PC(18:2(9Z,12Z)/20:3(8Z,11Z,14Z))
Spectrum type:Predicted LC-MS/MS Spectrum - 20V, Negative
Splash Key:splash10-01t9-0090000100-9323eaf0ecf3c2781f20
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:20 eV
Instrument Type:QTOF (generic), spectrum predicted by CFM-ID
Mass Resolution:0.0001 Da
Molecular Formula:C46H82NO8P
Molecular Weight (Monoisotopic Mass):807.5778 Da
Documentation
Document DescriptionDownload
List of m/z values for the spectrum (TXT)Download file582 Bytes
Generated list of m/z values for the spectrum (TXT-20190109-20465-1UTJCLW)Download file582 Bytes
mzML formatted file (MZML)Download file4.43 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.