Hmdb loader
Spectrum Details
HMDB ID:HMDB0060412
Compound name:6-Methylmercaptopurine
Spectrum type:Predicted LC-MS/MS Spectrum - 10V, Positive
Splash Key:splash10-014i-0900000000-efb7d7ad268f0baf9201
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:Positive
Collision Energy:10 eV
Instrument Type:QTOF (generic), spectrum predicted by CFM-ID
Mass Resolution:0.0001 Da
Molecular Formula:C6H6N4S
Molecular Weight (Monoisotopic Mass):166.0313 Da
Documentation
Document DescriptionDownload
Generated list of m/z values for the spectrum (TSV)Download file192 Bytes
Peak assignments (TSV)Download file440 Bytes
mzML formatted file (MZML)Download file4.23 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 ]