Spectrum Details
BMDB ID:BMDB0000145
Compound Name:Estrone
Derivative IUPAC Name:Not Available
Derivative SMILES:Not Available
Derivative InChIKey:Not Available
Spectrum Type:GC-MS Spectrum - GC-MS (1 MEOX; 1 TMS)
Splash Key:splash10-0019-8931000000-aad9803af812c7c40f53 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:2739.99
Column Type:5%-phenyl-95%-dimethylpolysiloxane capillary column
Derivative Type:1 MEOX; 1 TMS
Derivative Formula:C22H33NO2Si
Derivative Molecular Weight:371.589
Notes
Documentation
Document DescriptionDownloadFile Size
Golm MSL Record (TXT)Download file4.65 KB
Generated list of m/z values for the spectrum (TXT)Download file2.89 KB
mzML formatted file (MZML)Download file9.41 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) [f1906ae4-a931-466a-8402-be489bca5d99 ]