Predicted LC-MS/MS Spectrum - 20V, Negative (M2MDB000961)

Spectrum Details
ECMDB ID:ECMDB20113
Compound name:ADP-L-Glycero-D-manno-heptose
Spectrum type:Predicted LC-MS/MS Spectrum - 20V, Negative
Splash Key:splash10-001i-2901000000-baf9b8dcb69cf8da70fe 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
20406080100050100150200250300350400450500550600
050100150200250300350400450500550600
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:C17H27N5O16P2
Molecular Weight (Monoisotopic Mass):619.0928 Da
Molecular Weight (Avergae Mass):619.3677 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.