Spectrum Details
FooDB ID:FDB002558
Compound Name:Caffeic acid
Derivative IUPAC Name:Not Available
Derivative SMILES:Not Available
Derivative InChIKey:Not Available
Spectrum Type:GC-MS Spectrum - GC-MS (3 TMS)
Splash Key:splash10-014i-1593000000-b24e97b50ed1f50252f3 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:2135.55
Column Type:5%-phenyl-95%-dimethylpolysiloxane capillary column
Derivative Type:3 TMS
Derivative Formula:C18H32O4Si3
Derivative Molecular Weight:396.701
Document DescriptionDownloadFile Size
Golm MSL Record (TXT)Download file3.52 KB
Generated list of m/z values for the spectrum (TXT)Download file1.95 KB
mzML formatted file (MZML)Download file7.63 KB
  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) [5f2eb568-4f1c-4241-810d-95c2a13093f7 ]