| Molecule ID | SMILES | Charge States | Microspecies |
|---|---|---|---|
| mol13621 | Cc1cc(N)cc[n+]1[O-] | 2 | 2 |
| mol13622 | CNc1cccc[n+]1O | 2 | 2 |
| mol13623 | CNc1ccc[n+](O)c1 | 2 | 2 |
| mol13624 | CO[n+]1ccccc1N | 0 | 0 |
| mol13625 | CNc1cc[n+](O)cc1 | 2 | 2 |
| mol13626 | O=[N+]([O-])Nc1nnn[nH]1 | 4 | 5 |
| mol13627 | O=[N+]([O-])[N-]c1nnn[nH]1 | 2 | 3 |
| mol13628 | CN=C1CCCCC1C | 2 | 2 |
| mol13629 | CC(C)N1CCCCC1 | 2 | 2 |
| mol13630 | OC(O)c1ccncc1 | 2 | 3 |
| mol13631 | NCc1ccc(C=O)o1 | 2 | 2 |
| mol13632 | O=C(O)Cn1cccc1 | 2 | 2 |
| mol13633 | OC(O)c1ccccn1 | 2 | 4 |
| mol13634 | Cn1cccc1C(=O)O | 2 | 2 |
| mol13635 | OC(O)c1cccnc1 | 2 | 3 |
| mol13636 | ONc1ccc(O)cc1 | 3 | 4 |
| mol13637 | OCCN1CCOCC1 | 2 | 2 |
| mol13638 | CO[n+]1ccc(O)cc1 | 2 | 2 |
| mol13639 | CO[n+]1ccccc1O | 2 | 2 |
| mol13640 | COc1cccc[n+]1O | 2 | 2 |