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Spectrum Details
T3DB ID:T3D0116
Compound name:1,2,3-Trichlorobenzene
Spectrum type:Predicted LC-MS/MS Spectrum - 40V, Positive
Splash Key:splash10-001i-1900000000-5151abf41ae78f308554
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:C6H3Cl3
Molecular Weight (Monoisotopic Mass):179.93 Da
Documentation
Document DescriptionDownload
Generated list of m/z values for the spectrum (TSV)Download file88 Bytes
Peak assignments (TSV)Download file176 Bytes
mzML formatted file (MZML)Download file4.12 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 ]