Spectrum Details
FooDB ID:FDB031225
Compound name:trehalose-trans-methoxy-mono-mycolate
Spectrum type:Predicted LC-MS/MS Spectrum - 10V, Positive
Splash Key:splash10-0006-4140090010-86e5e034799709f2bdcb
Notes:This is a predicted spectrum and it should only be used as a guide, further evidence is required to confirm identification.
Spectrum View
Relative Intensity
20406080100
2040608010001002003004005006007008009001000110012001300140015001600
01002003004005006007008009001000110012001300140015001600
m/z
Experimental Conditions
Ionization Mode:Positive
Collision Energy:10 eV
Instrument Type:QTOF (generic), spectrum predicted by CFM-ID
Mass Resolution:0.0001 Da
Molecular Formula:C98H190O14
Molecular Weight (Monoisotopic Mass):1591.4156 Da
Documentation
Document DescriptionDownload
Generated list of m/z values for the spectrum (TSV)Download file1.13 KB
Peak assignments (TSV)Download file8 KB
mzML formatted file (MZML)Download file5.46 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 ]