Predicted LC-MS/MS Spectrum - 10V, Negative (M2MDB005339)

Spectrum Details
ECMDB ID:M2MDB005339
Compound name:1,3-beta-D-Glucan
Spectrum type:Predicted LC-MS/MS Spectrum - 10V, Negative
Splash Key:splash10-00di-0900000000-f8148fa88a5c80a5a60c 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
204060801000102030405060708090100110120130140150160170180
0102030405060708090100110120130140150160170180
m/z
Experimental Conditions
Ionization Mode:Negative
Collision Energy:10 eV
Instrument Type:QTOF (generic), spectrum predicted by CFM-ID
Mass Resolution:0.0001 Da
Molecular Formula:C6H6O4S
Molecular Weight (Monoisotopic Mass):173.9987 Da
Molecular Weight (Avergae Mass):174.174 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.