Spectrum Details
BMDB ID:BMDB0000210
Compound Name:Pantothenic acid
Derivative IUPAC Name:Not Available
Derivative SMILES:Not Available
Derivative InChIKey:Not Available
Spectrum Type:GC-MS Spectrum - GC-MS (4 TMS)
Splash Key:splash10-0f6t-3921000000-6a2222a87b5ffd328cee 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:1929.41
Column Type:5%-phenyl-95%-dimethylpolysiloxane capillary column
Derivative Type:4 TMS
Derivative Formula:C21H49NO5Si4
Derivative Molecular Weight:507.96
Notes
Documentation
Document DescriptionDownloadFile Size
Golm MSL Record (TXT)Download file3.83 KB
Generated list of m/z values for the spectrum (TXT)Download file2.08 KB
mzML formatted file (MZML)Download file7.86 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) [acc9c875-6377-4e41-9489-4ed82b01ed50 ]