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Spectrum Details
HMDB ID:HMDB0300501
Compound name:DG(18:1(12Z)-O(9S,10R)/0:0/i-22:0)
Spectrum type:Predicted LC-MS/MS Spectrum - 40V, Negative
Splash Key:splash10-00dj-3694000000-a9f5c77fb10ecf675683
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:40 eV
Instrument Type:QTOF (generic), spectrum predicted by CFM-ID
Mass Resolution:0.0001 Da
Molecular Formula:C43H80O6
Molecular Weight (Monoisotopic Mass):692.5955 Da
Documentation
Document DescriptionDownload
Generated list of m/z values for the spectrum (TSV)Download file178 Bytes
Peak assignments (TSV)Download file178 Bytes
mzML formatted file (MZML)Download file4.88 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 ]