BMFYS6CAp010
From Metabolomics.JP
(Difference between revisions)
| Line 2: | Line 2: | ||
|SysName=3-Oxo-hexanoic acid | |SysName=3-Oxo-hexanoic acid | ||
|Common Name=&&3-Oxohexanoic acid&&3-Oxohexanoate&& | |Common Name=&&3-Oxohexanoic acid&&3-Oxohexanoate&& | ||
| − | |CAS= | + | |CAS=4380-91-0 |
|KEGG=C02122 | |KEGG=C02122 | ||
}} | }} | ||
Revision as of 09:00, 14 July 2008
| IDs and Links | |
|---|---|
| LipidBank | [1] |
| LipidMaps | [2] |
| CAS | 4380-91-0 |
| KEGG | C02122 |
| KNApSAcK | |
| CDX file | |
| MOL file | BMFYS6CAp010.mol |
| 3-Oxohexanoic acid | |
|---|---|
| |
| Structural Information | |
| Systematic Name | 3-Oxo-hexanoic acid |
| Common Name |
|
| Symbol | |
| Formula | C6H10O3 |
| Exact Mass | 130.0629 |
| Average Mass | 130.1418 |
| SMILES | CCCC(=O)CC(O)=O |
| Physicochemical Information | |
| Melting Point | |
| Boiling Point | |
| Density | |
| Optical Rotation | |
| Reflactive Index | |
| Solubility | |
| Spectral Information | |
| Mass Spectra | |
| UV Spectra | |
| IR Spectra | |
| NMR Spectra | |
| Chromatograms | |
