EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C13H19N3O6S |
| Net Charge | 0 |
| Average Mass | 345.377 |
| Monoisotopic Mass | 345.09946 |
| SMILES | CCCN(CCC)c1c([N+](=O)[O-])cc(S(C)(=O)=O)cc1[N+](=O)[O-] |
| InChI | InChI=1S/C13H19N3O6S/c1-4-6-14(7-5-2)13-11(15(17)18)8-10(23(3,21)22)9-12(13)16(19)20/h8-9H,4-7H2,1-3H3 |
| InChIKey | UMKANAFDOQQUKE-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| Nitralin (CHEBI:82190) is a C-nitro compound (CHEBI:35716) |