GC-MS Spectrum - (2R,3R,4R,5R)-2,3,4,5,6-Pentahydroxyhexanal GC-MS (1 MEOX; 5 TMS) (HMDB0242534)
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 Description | Download | File Size |
|---|---|---|
| Golm MSL Record (TXT) | Download file | 3.45 KB |
| Generated list of m/z values for the spectrum (TXT) | Download file | 2.2 KB |
| mzML formatted file (MZML) | Download file | 8.07 KB |
References
- 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 ]
- Golm Metabolome Database (GMD) [337212da-02c0-4f1c-84c9-d4449f9800af ]