LBF09107BC01: Difference between revisions

Revision as of 00:00, 12 December 2008

Upper classes: LB LBF

GlcNAca/b1-3Xyla-4Galb1-3GalNAca1-4(NeuAc?1-2NeuGc4Mea1-3)GalNAcb1-4(EtnP-6)GlcNAcb1-3Manb1-4Glcb1-1Cer

Structural Information
	3-Methyl-2-Nonenoic Acid


Formula	C10H18O2
Exact Mass	170.13067981999998
Average Mass	170.24872
SMILES	`CCCCCCC(C)=CC(O)=O`
Physicochemical Information

	113 - 114°C/1mmHg Cason_J et al.

	h25/D = 1.4648 Cason_Jet al.








Spectral Information
Mass Spectra
UV Spectra	lmax 219mm Cason_Jet al.
IR Spectra	5.90(C=O), 6.10(C=C) Freeman_NK
NMR Spectra
Other Spectra
Chromatograms

Reported Metabolites, References

Biospecies	ID	Compound Name	Reference
n.a.	LBF09107BC01	See above.	Cason_J et al. 1951
n.a.	LBF09107BC01	See above.	Fieser_LF_et_al 1948
n.a.	LBF09107BC01	See above.	Freeman_NK 1953

@@ Line 5: / Line 5: @@
 |LipidMaps=LMFA01020128
 |SysName=3-Methyl-2-Nonenoic Acid
-|Boiling Point=113 - 114°C/1mmHg <<7011>>
+|Boiling Point=113 - 114°C/1mmHg [[Reference:Cason_J:Sumrell_G:,J. Org. Chem.,1951,16,1177|{{RelationTable/GetFirstAuthor|Reference:Cason_J:Sumrell_G:,J. Org. Chem.,1951,16,1177}}]]
-|Optical=<FONT FACE="Symbol">h</FONT>25/D = 1.4648 <<7011>>
+|Optical=<FONT FACE="Symbol">h</FONT>25/D = 1.4648 [[Reference:Cason_J:Sumrell_G:,J. Org. Chem.,1951,16,1177|{{RelationTable/GetFirstAuthor|Reference:Cason_J:Sumrell_G:,J. Org. Chem.,1951,16,1177}}]]
-|UV Spectra=<FONT FACE="Symbol">l</FONT>max 219m<FONT FACE="Symbol">m</FONT> <<7011>>
+|UV Spectra=<FONT FACE="Symbol">l</FONT>max 219m<FONT FACE="Symbol">m</FONT> [[Reference:Cason_J:Sumrell_G:,J. Org. Chem.,1951,16,1177|{{RelationTable/GetFirstAuthor|Reference:Cason_J:Sumrell_G:,J. Org. Chem.,1951,16,1177}}]]
-|IR Spectra=5.90(C=O), 6.10(C=C) <<7022>>
+|IR Spectra=5.90(C=O), 6.10(C=C) [[Reference:Freeman_NK:,J. Am. Chem. Soc.,1953,75,1859|{{RelationTable/GetFirstAuthor|Reference:Freeman_NK:,J. Am. Chem. Soc.,1953,75,1859}}]]
 }}