Hmdb loader
Spectrum Details
HMDB ID:HMDB0302994
Compound name:2-Heptyl acetate
Spectrum type:Predicted LC-MS/MS Spectrum - 40V, Positive
Splash Key:splash10-0006-9000000000-c4a662546edfd9d98e25
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
20406080100051015202530354045505560657075
051015202530354045505560657075
m/z
Experimental Conditions
Ionization Mode:Positive
Collision Energy:40 eV
Instrument Type:QTOF (generic), spectrum predicted by CFM-ID
Mass Resolution:0.0001 Da
Molecular Formula:C9H18O2
Molecular Weight (Monoisotopic Mass):158.1307 Da
Documentation
Document DescriptionDownload
Generated list of m/z values for the spectrum (TSV)Download file128 Bytes
Peak assignments (TSV)Download file209 Bytes
mzML formatted file (MZML)Download file4.17 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 ]