Spectrum Details
T3DB ID:T3D0163
Compound name:1,1,2-Trichloroethane
Spectrum type:Predicted LC-MS/MS Spectrum - 10V, Negative
Splash Key:splash10-001i-0900000000-6838b4c597e6d80ac4e2
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:C2H3Cl3
Molecular Weight (Monoisotopic Mass):131.93 Da
Documentation
Document DescriptionDownload
Generated list of m/z values for the spectrum (TSV)Download file39 Bytes
Peak assignments (TSV)Download file61 Bytes
mzML formatted file (MZML)Download file4.05 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 ]