Spectrum Details
T3DB ID:T3D2663
Compound name:Clodronate
Spectrum type:Predicted LC-MS/MS Spectrum - 40V, Positive
Splash Key:splash10-03ea-4900000000-e088c1d2fe760f01f20d
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:40 eV
Instrument Type:QTOF (generic), spectrum predicted by CFM-ID
Mass Resolution:0.0001 Da
Molecular Formula:CH4Cl2O6P2
Molecular Weight (Monoisotopic Mass):243.886 Da
Documentation
Document DescriptionDownload
Generated list of m/z values for the spectrum (TSV)Download file70 Bytes
Peak assignments (TSV)Download file127 Bytes
mzML formatted file (MZML)Download file4.09 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 ]