LBF18206EO01
From Metabolomics.JP
Upper classes
| IDs and Links | |
|---|---|
| LipidBank | DFA8073 |
| LipidMaps | LMFA01070014 |
| CAS | |
| KEGG | {{{KEGG}}} |
| KNApSAcK | |
| CDX file | |
| MOL file | LBF18206EO01.mol |
| |
| Structural Information | |
| Systematic Name | Methyl-15,16-Epoxy-9,12-Octadecadienoate |
| Common Name | |
| Symbol | |
| Formula | C19H32O3 |
| Exact Mass | 308.23514489 |
| Average Mass | 308.45558 |
| SMILES | C(CC=CCC=CCCCCCCCC(=O)OC)(O1)C(CC)1 |
| Physicochemical Information | |
| Melting Point | |
| Boiling Point | |
| Density | |
| Optical Rotation | |
| Reflactive Index | |
| Solubility | |
| Spectral Information | |
| Mass Spectra | GC-EI-MS<<8084>>: m/e=308[M]; 279[CH-(O)-CHCH2CH=CHCH2CH=CH(CH2)7COOCH3]; 277[M -OCH3]; 251[279-28]; 71[CH3CH2CH-(O)-CH]; 43[71-28]; GC-EI-MS(after hydrogenation)(105): m/e=281[M-OCH3]; 255[CH-(O)-CH(CH2)13COOCH3-28]; 71[CH3CH2CH-(O)-CH]; 43[71-28] |
| UV Spectra | |
| IR Spectra | Cis unsaturation: 3002cm-1<<8081>> |
| NMR Spectra | 1H-NMR<<8081>>: cis unsaturationS: 5.43ppm[4H]; cis epoxide ring:2.79 AND 2.98ppm[2H] |
| Chromatograms | |
