Spectrum Details
T3DB ID:T3D2911
Compound name:Nalbuphine
Spectrum type:Predicted LC-MS/MS Spectrum - 40V, Negative
Splash Key:splash10-0a4i-0019000000-3615de25291d9c20f0e3
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:40 eV
Instrument Type:QTOF (generic), spectrum predicted by CFM-ID
Mass Resolution:0.0001 Da
Molecular Formula:C21H27NO4
Molecular Weight (Monoisotopic Mass):357.194 Da
Documentation
Document DescriptionDownload
Generated list of m/z values for the spectrum (TSV)Download file735 Bytes
Peak assignments (TSV)Download file2.86 KB
mzML formatted file (MZML)Download file4.97 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 ]