Spectrum Details
BMDB ID:BMDB0000230
Compound Name:N-Acetylneuraminic acid
Derivative IUPAC Name:Not Available
Derivative SMILES:Not Available
Derivative InChIKey:Not Available
Spectrum Type:GC-MS Spectrum - GC-MS (1 MEOX; 7 TMS)
Splash Key:splash10-00l6-1792200000-863a168c10243229e892 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:2654.67
Column Type:5%-phenyl-95%-dimethylpolysiloxane capillary column
Derivative Type:1 MEOX; 7 TMS
Derivative Formula:C33H78N2O9Si7
Derivative Molecular Weight:843.58
Notes
Documentation
Document DescriptionDownloadFile Size
Golm MSL Record (TXT)Download file6.13 KB
Generated list of m/z values for the spectrum (TXT)Download file3.99 KB
mzML formatted file (MZML)Download file11.3 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) [2e26fb76-98d9-4f71-82e1-81c3527481f7 ]