Hmdb loader
Spectrum Details
HMDB ID:HMDB0086138
Compound name:CL(i-12:0/i-12:0/i-12:0/a-13:0)[rac]
Spectrum type:Predicted LC-MS/MS Spectrum - 40V, Negative
Splash Key:splash10-01ot-0669110000-aad96b68659bc6a143de
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
20406080100050100150200250300350400450500550
050100150200250300350400450500550
m/z
Experimental Conditions
Ionization Mode:Negative
Collision Energy:40 eV
Instrument Type:QTOF (generic), spectrum predicted by CFM-ID
Mass Resolution:0.0001 Da
Molecular Formula:C58H112O17P2
Molecular Weight (Monoisotopic Mass):1142.7375 Da
Documentation
Document DescriptionDownload
List of m/z values for the spectrum (TXT)Download file102 Bytes
List of m/z values for the spectrum (TXT)Download file102 Bytes
Generated list of m/z values for the spectrum (TXT-20190109-20465-37NDDW)Download file102 Bytes
mzML formatted file (MZML)Download file4.07 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.