Spectrum Details
MiMe ID:MMDBc0031690
Compound name:13-[O(2')-beta-D-Glucopyranosyl-beta-D-glucopyranosyloxy]docoscanoate O(6'')-acetate
Spectrum type:Predicted LC-MS/MS Spectrum - 10V, Positive
Splash Key:splash10-05fr-1016031900-631d32bbc2de3d9db5f8
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:Positive
Collision Energy:10 eV
Instrument Type:QTOF (generic), spectrum predicted by CFM-ID
Mass Resolution:0.0001 Da
Molecular Formula:C36H65O14
Molecular Weight (Monoisotopic Mass):721.4374 Da
Documentation
Document DescriptionDownload
List of m/z values for the spectrum (TXT)Download file747 Bytes
Generated list of m/z values for the spectrum (TXT-20190109-20465-GMTWWP)Download file747 Bytes
mzML formatted file (MZML)Download file4.58 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.