Spectrum Details
BMDB ID:BMDB0006525
Compound name:(+)-a-Pinene
Spectrum type:Predicted LC-MS/MS Spectrum - 20V, Negative
Splash Key:splash10-000i-0900000000-a013b4ae27f975ab5621
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:C10H16
Molecular Weight (Monoisotopic Mass):136.1252 Da
Documentation
Document DescriptionDownload
Generated list of m/z values for the spectrum (TSV)Download file39 Bytes
Peak assignments (TSV)Download file69 Bytes
mzML formatted file (MZML)Download file4.05 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 ]