Spectrum Details
MiMe ID:MMDBc0032013
Compound Name:Gentisate aldehyde
Derivative IUPAC Name:Not Available
Derivative SMILES:Not Available
Derivative InChIKey:Not Available
Spectrum Type:GC-MS Spectrum - GC-MS (1 MEOX; 2 TMS)
Splash Key:splash10-00kp-5960000000-bec903f315e1845244d7 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:1709.76
Column Type:5%-phenyl-95%-dimethylpolysiloxane capillary column
Derivative Type:1 MEOX; 2 TMS
Derivative Formula:C14H25NO3Si2
Derivative Molecular Weight:311.525
Notes
Documentation
Document DescriptionDownloadFile Size
Golm MSL Record (TXT)Download file4.07 KB
Generated list of m/z values for the spectrum (TXT)Download file2.53 KB
mzML formatted file (MZML)Download file8.82 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) [da55ac71-142f-4767-be14-f7110e95d3c1 ]