Predicted LC-MS/MS Spectrum - 20V, Negative (YMDB00712)

Spectrum Details
YMDB ID:YMDB00712
Compound name:inositol-P-ceramide C (C26)
Spectrum type:Predicted LC-MS/MS Spectrum - 20V, Negative
Splash Key:splash10-0a6r-4195002002-f5be503ee3ee4233e1d8 View in MoNA
Notes:This is a predicted spectrum and it should only be used as a guide, further evidence is required to confirm identification.
Spectrum View
Relative Intensity
20406080100
20406080100050100150200250300350400450500550600650700750800850900950
050100150200250300350400450500550600650700750800850900950
m/z
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:C50H100NO13P
Molecular Weight (Monoisotopic Mass):953.6932 Da
Molecular Weight (Avergae Mass):954.3017 Da
Documentation
Document DescriptionDownload
List of m/z values for the spectrumDownload file
Generated list of m/z values for the spectrumDownload file
mzML formatted fileDownload file
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.