LBF12110BC02
From Metabolomics.JP
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{{Metabolite | {{Metabolite | ||
|LipidBank=DFA7075 | |LipidBank=DFA7075 | ||
Latest revision as of 09:00, 1 October 2008
Upper classes
| IDs and Links | |
|---|---|
| LipidBank | DFA7075 |
| LipidMaps | LMFA01020107 |
| CAS | |
| KEGG | {{{KEGG}}} |
| KNApSAcK | |
| CDX file | |
| MOL file | LBF12110BC02.mol |
| |
| Structural Information | |
| Systematic Name | 2-Methyl-2-Dodecenoic Acid |
| Common Name | |
| Symbol | |
| Formula | C13H24O2 |
| Exact Mass | 212.17763001199998 |
| Average Mass | 212.32845999999998 |
| SMILES | CCCCCCCCCC=C(C)C(O)=O |
| Physicochemical Information | |
| Melting Point | 33°C <<7023>> |
| Boiling Point | 146-147°C/1.4mmHg <<7081>> |
| Density | |
| Optical Rotation | h25/D: 1.4698 <<7023>> |
| Reflactive Index | |
| Solubility | |
| Spectral Information | |
| Mass Spectra | |
| UV Spectra | l%max: 218nm, emax: 11330<<7023>> |
| IR Spectra | C=O: 1692cm-1, C=C: 1645cm-1, Methyl: 1379cm-1<<7022>> |
| NMR Spectra | |
| Chromatograms | |
