Spectrum Details
chemdb ID:CHEM042191
Compound Name:D-ononitol
Spectrum Type:GC-MS Spectrum - GC-MS (5 TMS)
Splash Key:splash10-07vi-1894100000-01b1002de6336de791eb View in MoNA
Spectrum View
Experimental Conditions
Instrument Type:GC-MS
Chromatography Type:GC
Retention Index Type:based on 9 n-alkanes (C10–C36)
Retention Index:1817.76
Column Type:5%-phenyl-95%-dimethylpolysiloxane capillary column
Derivative Type:5 TMS
Derivative Formula:C22H54O6Si5
Derivative Molecular Weight:555.088
Notes
Documentation
Document DescriptionDownload
Golm MSL RecordDownload file
Generated list of m/z values for the spectrumDownload file
mzML formatted fileDownload file
References
  1. Hummel J, Strehmel N, Selbig J, Walther D, Kopka J: Decision tree supported substructure prediction of metabolites from GC-MS profiles. Metabolomics. 2010 Jun;6(2):322-333. Epub 2010 Feb 16. [PubMed: 20526350 ]
  2. Golm Metabolome Database (GMD) [dfedbee2-6b66-4b52-b802-dbd1df6905c0 ]