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Spectrum Details
T3DB ID:T3D4503
Compound name:Ethylenethiourea
Spectrum type:Predicted LC-MS/MS Spectrum - 20V, Positive
Splash Key:splash10-0udi-4900000000-8a2ef4170a7006cb3b29
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:20 eV
Instrument Type:QTOF (generic), spectrum predicted by CFM-ID
Mass Resolution:0.0001 Da
Molecular Formula:C3H6N2S
Molecular Weight (Monoisotopic Mass):102.0252 Da
Documentation
Document DescriptionDownload
Generated list of m/z values for the spectrum (TSV)Download file228 Bytes
Peak assignments (TSV)Download file411 Bytes
mzML formatted file (MZML)Download file4.32 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 ]