Spectrum Details
MiMe ID:MMDBc0000556
Compound Name:Suberic acid
Derivative IUPAC Name:Not Available
Derivative SMILES:Not Available
Derivative InChIKey:Not Available
Spectrum Type:GC-MS Spectrum - GC-MS (2 TMS)
Splash Key:splash10-00kr-4910000000-5746b8e489013c10f927 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:1698.82
Column Type:5%-phenyl-95%-dimethylpolysiloxane capillary column
Derivative Type:2 TMS
Derivative Formula:C14H30O4Si2
Derivative Molecular Weight:318.557
Notes
Documentation
Document DescriptionDownloadFile Size
Golm MSL Record (TXT)Download file2.61 KB
Generated list of m/z values for the spectrum (TXT)Download file1.16 KB
mzML formatted file (MZML)Download file6.21 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) [cf5a5997-f321-4fc7-b23c-78deb14ab2de ]