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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 TMS)
Splash Key:splash10-05ox-3951000000-8bc438f505b3cf49b21f 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:2697.97
Column Type:5%-phenyl-95%-dimethylpolysiloxane capillary column
Derivative Type:1 TMS
Derivative Formula:C21H30O2Si
Derivative Molecular Weight:342.548
Notes
Documentation
Document DescriptionDownloadFile Size
Golm MSL Record (TXT)Download file5.68 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) [bb21739f-7334-46a7-a4a3-4f410c18577f ]