Spectrum Details
FooDB ID:FDB029229
Compound name:Isoniazid
Spectrum type:Predicted LC-MS/MS Spectrum - 10V, Negative
Splash Key:splash10-002r-7900000000-1e1d0995890b4dca1772
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:C6H7N3O
Molecular Weight (Monoisotopic Mass):137.0589 Da
Documentation
Document DescriptionDownload
Generated list of m/z values for the spectrum (TSV)Download file150 Bytes
Peak assignments (TSV)Download file304 Bytes
mzML formatted file (MZML)Download file4.19 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 ]