GC-MS Spectrum - GC-MS (5 TMS) (CHEM021937)
Spectrum Details
chemdb ID: | CHEM021937 |
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Compound Name: | Rosmarinic acid |
Spectrum Type: | GC-MS Spectrum - GC-MS (5 TMS) |
Splash Key: | splash10-00kb-1889000000-a18403fdf27acdd9420a View in MoNA |
Spectrum View
Experimental Conditions
Instrument Type: | GC-MS |
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Chromatography Type: | GC |
Retention Index Type: | based on 9 n-alkanes (C10–C36) |
Retention Index: | 3400.96 |
Column Type: | 5%-phenyl-95%-dimethylpolysiloxane capillary column |
Derivative Type: | 5 TMS |
Derivative Formula: | C33H56O8Si5 |
Derivative Molecular Weight: | 721.221 |
Notes
Documentation
Document Description | Download |
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Golm MSL Record | Download file |
Generated list of m/z values for the spectrum | Download file |
mzML formatted file | Download file |
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) [2133f409-3c2a-4eaa-a30e-8a8d531fad25 ]