EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C9H9NO5 |
| Net Charge | 0 |
| Average Mass | 211.173 |
| Monoisotopic Mass | 211.04807 |
| SMILES | COC(=O)OCc1ccc([N+](=O)[O-])cc1 |
| InChI | InChI=1S/C9H9NO5/c1-14-9(11)15-6-7-2-4-8(5-3-7)10(12)13/h2-5H,6H2,1H3 |
| InChIKey | CTKAQWBPFDASQZ-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| methyl 4-nitrobenzyl carbonate (CHEBI:140630) is a carbonate ester (CHEBI:46722) |
| Synonyms | Source |
|---|---|
| p-nitrobenzyl methyl carbonate | ChEBI |
| carbonic acid methyl ester 4-nitrobenzyl ester | ChEBI |
| carbonic acid, methyl (4-nitrophenyl)methyl ester | ChEBI |
| Registry Numbers | Sources |
|---|---|
| Reaxys:3311877 | Reaxys |
| Citations |
|---|