Spectrum Details
BMDB ID:BMDB0000429
Compound Name:17a-Estradiol
Derivative IUPAC Name:Not Available
Derivative SMILES:Not Available
Derivative InChIKey:Not Available
Spectrum Type:GC-MS Spectrum - GC-MS (2 TMS)
Splash Key:splash10-00p0-3970000000-ea6c869f7a3556f5fb55 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:2679.37
Column Type:5%-phenyl-95%-dimethylpolysiloxane capillary column
Derivative Type:2 TMS
Derivative Formula:C24H40O2Si2
Derivative Molecular Weight:416.745
Notes
Documentation
Document DescriptionDownloadFile Size
Golm MSL Record (TXT)Download file5.74 KB
Generated list of m/z values for the spectrum (TXT)Download file3.77 KB
mzML formatted file (MZML)Download file11 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) [eea37bfc-aa54-44cc-8169-ddba496a068e ]