LBF20118BC02
From Metabolomics.JP
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{{Metabolite | {{Metabolite | ||
|LipidBank=DFA7104 | |LipidBank=DFA7104 | ||
Latest revision as of 09:00, 1 October 2008
Upper classes
| IDs and Links | |
|---|---|
| LipidBank | DFA7104 |
| LipidMaps | LMFA01020136 |
| CAS | |
| KEGG | {{{KEGG}}} |
| KNApSAcK | |
| CDX file | |
| MOL file | LBF20118BC02.mol |
| |
| Structural Information | |
| Systematic Name | 2-Methyl-2-Icosenoic Acid |
| Common Name | |
| Symbol | |
| Formula | C21H40O2 |
| Exact Mass | 324.302830524 |
| Average Mass | 324.5411 |
| SMILES | C(CCCCCCCCCCCCCC=C(C)C(O)=O)CCC |
| Physicochemical Information | |
| Melting Point | 66.3 - 67.6°C <<7081>> |
| Boiling Point | 203 - 205°C/2.5mmHg(Me ESTER) <<7106>> |
| Density | |
| Optical Rotation | |
| Reflactive Index | |
| Solubility | |
| Spectral Information | |
| Mass Spectra | |
| UV Spectra | lmax 217nm (emax 13,490) <<7081>> |
| IR Spectra | C=C: 12.60m, 13.52m, 15.50m <<7106>> |
| NMR Spectra | |
| Chromatograms | |
