LBF18208HP01: Difference between revisions

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{{Lipid/Header}}
{{Hierarchy|{{PAGENAME}}}}
{{Hierarchy|{{PAGENAME}}}}


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|LipidBank=DFA8048
|LipidBank=DFA8048
|LipidMaps=LMFA01040036
|LipidMaps=LMFA01040036
|SysName=Methyl 9-Butylperoxy-10,12-Octadecadienoate
|SysName=Methyl-9-butyl-peroxy-10,12-octadecadienoic acid
|Mass Spectra=GC-EI-MS(hydrogenation with palladium-charcoal)<<8057>>
|Common Name=&&Methyl-9-butyl-peroxy-10,12-octadecadienoic acid&&
|UV Spectra=<FONT FACE="Symbol">l</FONT>ether/max=234nm<<8057>>
|Mass Spectra=GC-EI-MS(hydrogenation with palladium-charcoal)[[Reference:Schieberle_P:Grosch_W:,Z. Lebensm. Unters. Forsch.,1981,173,192|{{RelationTable/GetFirstAuthor|Reference:Schieberle_P:Grosch_W:,Z. Lebensm. Unters. Forsch.,1981,173,192}}]]
|IR Spectra=Ester carbonyl(1740cm<SUP><FONT SIZE=-1>-</FONT></SUP><SUP><FONT SIZE=-1>1</FONT></SUP>), trans, trans diene(991cm<SUP><FONT SIZE=-1>-</FONT></SUP><SUP><FONT SIZE=-1>1</FONT></SUP>)<<8057>>
|UV Spectra= lambda ether/max=234nm[[Reference:Schieberle_P:Grosch_W:,Z. Lebensm. Unters. Forsch.,1981,173,192|{{RelationTable/GetFirstAuthor|Reference:Schieberle_P:Grosch_W:,Z. Lebensm. Unters. Forsch.,1981,173,192}}]]
|NMR Spectra=<SUP><FONT SIZE=-1>1</FONT></SUP>H-NMR<<8057>>: C10-C13(5.5-6.1ppm), C9(4.1ppm), C14(2.1ppm)
|IR Spectra=Ester carbonyl(1740cm^{-1}), trans, trans diene(991cm^{-1})[[Reference:Schieberle_P:Grosch_W:,Z. Lebensm. Unters. Forsch.,1981,173,192|{{RelationTable/GetFirstAuthor|Reference:Schieberle_P:Grosch_W:,Z. Lebensm. Unters. Forsch.,1981,173,192}}]]
|NMR Spectra=^1 H-NMR[[Reference:Schieberle_P:Grosch_W:,Z. Lebensm. Unters. Forsch.,1981,173,192|{{RelationTable/GetFirstAuthor|Reference:Schieberle_P:Grosch_W:,Z. Lebensm. Unters. Forsch.,1981,173,192}}]]: C10-C13(5.5-6.1ppm), C9(4.1ppm), C14(2.1ppm)
|Source=A degradation product of 13-hydroperoxymethyllinoleate in the presence of di-tert-butyl peroxyoxalate[[Reference:Schieberle_P:Grosch_W:,Z. Lebensm. Unters. Forsch.,1981,173,192|{{RelationTable/GetFirstAuthor|Reference:Schieberle_P:Grosch_W:,Z. Lebensm. Unters. Forsch.,1981,173,192}}]].
|Chemical Synthesis=
|Metabolism=
}}
}}
{{Lipid/Footer}}

Latest revision as of 17:09, 26 May 2010

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Upper classes: LB LBF



IDs and Links
LipidBank DFA8048
LipidMaps LMFA01040036
CAS
KEGG {{{KEGG}}}
KNApSAcK {{{KNApSAcK}}}
mol LBF18208HP01
Methyl-9-butyl-peroxy-10,12-octadecadienoic acid
Structural Information
Methyl-9-butyl-peroxy-10,12-octadecadienoic acid
  • Methyl-9-butyl-peroxy-10,12-octadecadienoic acid
Formula C23H42O4
Exact Mass 382.30830983199996
Average Mass 382.57718
SMILES C(CCCC(=O)OC)CCCC(OOC(C)(C)C)C=CC=CCCCCC
Physicochemical Information
A degradation product of 13-hydroperoxymethyllinoleate in the presence of di-tert-butyl peroxyoxalate Schieberle_P et al..
Spectral Information
Mass Spectra GC-EI-MS(hydrogenation with palladium-charcoal) SchieberlePet al.
UV Spectra λ ether/max=234nm SchieberlePet al.
IR Spectra Ester carbonyl(1740cm-1), trans, trans diene(991cm-1) SchieberlePet al.
NMR Spectra 1H-NMR SchieberlePet al.: C10-C13(5.5-6.1ppm), C9(4.1ppm), C14(2.1ppm)
Other Spectra
Chromatograms
Reported Metabolites, References
Biospecies ID Compound Name Reference Comment
n.a. LBF18208HP01 See above. Schieberle_P et al. 1981


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