BMMCBZ2On016
From Metabolomics.JP
(Difference between revisions)
Revision as of 09:00, 25 July 2008
| IDs and Links | |
|---|---|
| LipidBank | [1] |
| LipidMaps | [2] |
| CAS | 22364-68-7 |
| KEGG | C02596 |
| KNApSAcK | |
| CDX file | |
| MOL file | BMMCBZ2On016.mol |
| Tolylacetonitrile | |
|---|---|
| |
| Structural Information | |
| Systematic Name | 2-Methyl-benzene-acetonitrile |
| Common Name |
|
| Symbol | |
| Formula | C9H9N |
| Exact Mass | 131.0734 |
| Average Mass | 131.1745 |
| SMILES | N#CCc(c1)c(C)ccc1 |
| Physicochemical Information | |
| Melting Point | |
| Boiling Point | |
| Density | |
| Optical Rotation | |
| Reflactive Index | |
| Solubility | |
| Spectral Information | |
| Mass Spectra | |
| UV Spectra | |
| IR Spectra | |
| NMR Spectra | |
| Chromatograms | |
