Predicted LC-MS/MS Spectrum - 10V, Negative (FDB000337)

Spectrum Details
FooDB ID:FDB000337
Compound name:Mellein
Spectrum type:Predicted LC-MS/MS Spectrum - 10V, Negative
Splash Key:splash10-0059-0900000000-289cf6e04ee44d556ba3
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:C10H10O3
Molecular Weight (Monoisotopic Mass):178.063 Da
Documentation
Document DescriptionDownload
List of m/z values for the spectrum (TXT)Download file764 Bytes
Generated list of m/z values for the spectrum (TXT-20190109-20465-16DYQB2)Download file764 Bytes
mzML formatted file (MZML)Download file4.57 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.