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Spectrum Details
HMDB ID:HMDB0015584
Compound name:Maraviroc
Spectrum type:Predicted LC-MS/MS Spectrum - 40V, Negative
Splash Key:splash10-01xx-4840920000-a408d897f59b74eddc6b
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:C29H41F2N5O
Molecular Weight (Monoisotopic Mass):513.3279 Da
Documentation
Document DescriptionDownload
Generated list of m/z values for the spectrum (TSV)Download file1.09 KB
Peak assignments (TSV)Download file4.2 KB
mzML formatted file (MZML)Download file5.46 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 ]