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Spectrum Details
HMDB ID:HMDB0300133
Compound name:DG(22:6(4Z,7Z,10Z,12E,16Z,19Z)-OH(14)/0:0/i-20:0)
Spectrum type:Predicted LC-MS/MS Spectrum - 20V, Negative
Splash Key:splash10-03dl-2019001100-d79034d29c7d9ea2e7e7
Notes:This is a predicted spectrum and it should only be used as a guide, further evidence is required to confirm identification.
Spectrum View
Experimental Conditions
Ionization Mode:Negative
Collision Energy:20 eV
Instrument Type:QTOF (generic), spectrum predicted by CFM-ID
Mass Resolution:0.0001 Da
Molecular Formula:C45H76O6
Molecular Weight (Monoisotopic Mass):712.5642 Da
Documentation
Document DescriptionDownload
Generated list of m/z values for the spectrum (TSV)Download file770 Bytes
Peak assignments (TSV)Download file2.44 KB
mzML formatted file (MZML)Download file5.07 KB
References
  1. Wang F, Liigand J, Tian S, Arndt D, Greiner R, and Wishart D. CFM-ID 4.0: More Accurate ESI MS/MS Spectral Prediction and Compound Identification. Analytical Chemistry202193 (34), 11692-11700 DOI: 10.1021/acs.analchem.1c01465 [PubMed: 34403256 ]