LBF09000OX04
From Metabolomics.JP
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{{Metabolite | {{Metabolite | ||
|LipidBank=DFA0409 | |LipidBank=DFA0409 | ||
Latest revision as of 09:00, 1 October 2008
Upper classes
| IDs and Links | |
|---|---|
| LipidBank | DFA0409 |
| LipidMaps | LMFA01060025 |
| CAS | |
| KEGG | {{{KEGG}}} |
| KNApSAcK | |
| CDX file | |
| MOL file | LBF09000OX04.mol |
| n-Butyryl-n-valeric acid | |
|---|---|
| |
| Structural Information | |
| Systematic Name | 6-Oxononanoic acid |
| Common Name |
|
| Symbol | |
| Formula | C9H16O3 |
| Exact Mass | 172.109944378 |
| Average Mass | 172.22154 |
| SMILES | CCCC(=O)CCCCC(O)=O |
| Physicochemical Information | |
| Melting Point | 43 °C / 154-155 °C [ semi-carbazone ] |
| Boiling Point | 140-142 °C at 1 mmHg |
| Density | |
| Optical Rotation | |
| Reflactive Index | |
| Solubility | <<0393> |
| Spectral Information | |
| Mass Spectra | |
| UV Spectra | |
| IR Spectra | |
| NMR Spectra | |
| Chromatograms | |
