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Spectrum Details
T3DB ID:T3D3455
Compound name:2,3,3-Trimethylpentane
Spectrum type:Predicted LC-MS/MS Spectrum - 20V, Negative
Splash Key:splash10-03di-0900000000-599151a1113226b20586
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:20 eV
Instrument Type:QTOF (generic), spectrum predicted by CFM-ID
Mass Resolution:0.0001 Da
Molecular Formula:C8H18
Molecular Weight (Monoisotopic Mass):114.1409 Da
Documentation
Document DescriptionDownload
List of m/z values for the spectrum (TXT)Download file393 Bytes
Generated list of m/z values for the spectrum (TXT-20190109-20465-1U801IA)Download file393 Bytes
mzML formatted file (MZML)Download file4.27 KB
References
  1. Allen F, Greiner R, Wishart D: Competitive fragmentation modeling of ESI-MS/MS spectra for putative metabolite identification. Metabolomics. 2015 11(1):98–110. doi: 10.1007/s11306-014-0676-4.