Predicted LC-MS/MS Spectrum

(+-)-7-(3,5,6-trimethyl-1,4-benzoquinon-2-yl)-7-phenylheptanoic acid

Spectrum Details
Compound Name(+-)-7-(3,5,6-trimethyl-1,4-benzoquinon-2-yl)-7-phenylheptanoic acid
Spectrum TypePredicted LC-MS/MS Spectrum
Splash Keysplash10-0a4r-0039000000-9d68c9081ca17f1e520d
Spectrum View
Experimental Conditions
Ionization ModePositive
Collision Energylow
Collision Energy (V)10
Notes

Predicted by CFM-ID

Documentation
Document DescriptionDownload
List of m/z values for the spectrum (TXT)Download file
Generated list of m/z values for the spectrum (TXT)Download file
References
  • 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.