Spectrum Details
BMDB ID:BMDB0006525
Compound name:(+)-a-Pinene
Spectrum type:Predicted LC-MS/MS Spectrum - 40V, Negative
Splash Key:splash10-00kr-0900000000-b5dcbaea24fd03f1cbf9
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:C10H16
Molecular Weight (Monoisotopic Mass):136.1252 Da
Documentation
Document DescriptionDownload
List of m/z values for the spectrum (TXT)Download file96 Bytes
Generated list of m/z values for the spectrum (TXT-20190109-20465-1QBCQF3)Download file96 Bytes
mzML formatted file (MZML)Download file4 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.