Hmdb loader
Spectrum Details
HMDB ID:HMDB0203278
Compound name:CL(12:0/i-13:0/i-16:0/i-16:0)
Spectrum type:Predicted LC-MS/MS Spectrum - 10V, Negative
Splash Key:splash10-004i-0130009000-94416b0e512de19f0e94
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:10 eV
Instrument Type:QTOF (generic), spectrum predicted by CFM-ID
Mass Resolution:0.0001 Da
Molecular Formula:C66H128O17P2
Molecular Weight (Monoisotopic Mass):1254.8627 Da
Documentation
Document DescriptionDownload
Generated list of m/z values for the spectrum (TSV)Download file98 Bytes
Peak assignments (TSV)Download file330 Bytes
mzML formatted file (MZML)Download file4.17 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 ]