Spectrum Details
BMDB ID:BMDB0000562
Compound Name:Creatinine
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-0901000000-bd882951c92733ecbc9e 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:1553.67
Column Type:5%-phenyl-95%-dimethylpolysiloxane capillary column
Derivative Type:3 TMS
Derivative Formula:C13H31N3OSi3
Derivative Molecular Weight:329.662
Notes
Documentation
Document DescriptionDownloadFile Size
Golm MSL Record (TXT)Download file4.68 KB
Generated list of m/z values for the spectrum (TXT)Download file2.87 KB
mzML formatted file (MZML)Download file9.57 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) [cd163a4d-91f3-4444-bb71-df318e92f470 ]