LBF08000BC03: Difference between revisions
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|LipidMaps=LMFA01020088 | |LipidMaps=LMFA01020088 | ||
|SysName=2-Methyloctanoic Acid | |SysName=2-Methyloctanoic Acid | ||
|Boiling Point=163°C/2mmHg, 244-246°C/760mmHg | |Boiling Point=163°C/2mmHg, 244-246°C/760mmHg | ||
|Density=D0/4: 0.9098, D18/: 0.90325 | |Density=D0/4: 0.9098, D18/: 0.90325 | ||
|Optical=<FONT FACE="Symbol">h</FONT>25/D: 1.4274 | |Optical=<FONT FACE="Symbol">h</FONT>25/D: 1.4274 [[Reference:Wotiz_JH:Palchak_RJ:,J. Am. Chem. Soc.,1951,73,1971|{{RelationTable/GetFirstAuthor|Reference:Wotiz_JH:Palchak_RJ:,J. Am. Chem. Soc.,1951,73,1971}}]] | ||
}} | }} | ||
Revision as of 00:00, 12 December 2008
| IDs and Links | |
|---|---|
| LipidBank | DFA7056 |
| LipidMaps | LMFA01020088 |
| CAS | |
| KEGG | {{{KEGG}}} |
| KNApSAcK | {{{KNApSAcK}}} |
| mol | LBF08000BC03 |
| GlcNAca/b1-3Xyla-4Galb1-3GalNAca1-4(NeuAc?1-2NeuGc4Mea1-3)GalNAcb1-4(EtnP-6)GlcNAcb1-3Manb1-4Glcb1-1Cer | |
|---|---|
| |
| Structural Information | |
| 2-Methyloctanoic Acid | |
| Formula | C9H18O2 |
| Exact Mass | 158.13067981999998 |
| Average Mass | 158.23802 |
| SMILES | CCCCCCC(C)C(O)=O |
| Physicochemical Information | |
| 163°C/2mmHg, 244-246°C/760mmHg | |
| D0/4: 0.9098, D18/: 0.90325 | |
| h25/D: 1.4274 Wotiz_JH et al. | |
| Spectral Information | |
| Mass Spectra | |
| UV Spectra | |
| IR Spectra | |
| NMR Spectra | |
| Other Spectra | |
| Chromatograms | |
| Reported Metabolites, References | ||||||||||
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