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CHEBI:125482 - 2-acetyloxybenzoic acid [3-(nitrooxymethyl)phenyl] ester
| Formula | C16H13NO7 |
| Net Charge | 0 |
| Average Mass | 331.280 |
| Monoisotopic Mass | 331.06920 |
| SMILES | CC(=O)Oc1ccccc1C(=O)Oc1cccc(CO[N+](=O)[O-])c1 |
| InChI | InChI=1S/C16H13NO7/c1-11(18)23-15-8-3-2-7-14(15)16(19)24-13-6-4-5-12(9-13)10-22-17(20)21/h2-9H,10H2,1H3 |
| InChIKey | IOJUJUOXKXMJNF-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 2-acetyloxybenzoic acid [3-(nitrooxymethyl)phenyl] ester (CHEBI:125482) is a carbonyl compound (CHEBI:36586) |
| Manual Xrefs | Databases |
|---|---|
| LSM-36980 | LINCS |