Spectrum Details
CDB ID:CDB000144
Compound Name:Myoinositol
Derivative IUPAC Name:Not Available
Derivative SMILES:Not Available
Derivative InChIKey:Not Available
Spectrum Type:GC-MS Spectrum - GC-MS (6 TMS)
Splash Key:splash10-066r-0975000000-df7304c12b6c9bdb0f76 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:2080.23
Column Type:5%-phenyl-95%-dimethylpolysiloxane capillary column
Derivative Type:6 TMS
Derivative Formula:C24H60O6Si6
Derivative Molecular Weight:613.243
Notes
Documentation
Document DescriptionDownloadFile Size
Golm MSL Record (TXT)Download file3.14 KB
Generated list of m/z values for the spectrum (TXT)Download file1.43 KB
mzML formatted file (MZML)Download file6.69 KB
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) [6176bb6d-9d93-4714-b906-c7a54e0d3325 ]