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Spectrum Details
HMDB ID:HMDB0242534
Compound Name:(2R,3R,4R,5R)-2,3,4,5,6-Pentahydroxyhexanal
Derivative IUPAC Name:Not Available
Derivative SMILES:Not Available
Derivative InChIKey:Not Available
Spectrum Type:GC-MS Spectrum - (2R,3R,4R,5R)-2,3,4,5,6-Pentahydroxyhexanal GC-MS (1 MEOX; 5 TMS)
Splash Key:splash10-0ldi-1931000000-16aec275770f5676c75a 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:1887.55
Column Type:5%-phenyl-95%-dimethylpolysiloxane capillary column
Derivative Type:1 MEOX; 5 TMS
Derivative Formula:C22H55NO6Si5
Derivative Molecular Weight:570.103
Notes
Documentation
Document DescriptionDownloadFile Size
Golm MSL Record (TXT)Download file3.45 KB
Generated list of m/z values for the spectrum (TXT)Download file2.2 KB
mzML formatted file (MZML)Download file8.07 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) [337212da-02c0-4f1c-84c9-d4449f9800af ]