Predicted LC-MS/MS Spectrum - 10V, Positive (FDB034572)

Spectrum Details
FooDB ID:FDB034572
Compound name:3',5'-Diiodo-L-thyronine 4'-O-sulfate
Spectrum type:Predicted LC-MS/MS Spectrum - 10V, Positive
Splash Key:splash10-0a4r-0000092000-86cc40dd46f3110ec7f0
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:Positive
Collision Energy:10 eV
Instrument Type:QTOF (generic), spectrum predicted by CFM-ID
Mass Resolution:0.0001 Da
Molecular Formula:C15H13I2NO7S
Molecular Weight (Monoisotopic Mass):604.8502 Da
Documentation
Document DescriptionDownload
List of m/z values for the spectrum (TXT)Download file305 Bytes
Generated list of m/z values for the spectrum (TXT-20190109-20465-1KOHHU4)Download file305 Bytes
mzML formatted file (MZML)Download file4.2 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.