| Molecule ID | SMILES | Charge States | Microspecies |
|---|---|---|---|
| mol10061 | O=Cc1cccc(Cl)c1O | 2 | 2 |
| mol10062 | O=Cc1cc(Cl)ccc1O | 2 | 2 |
| mol10063 | O=Cc1ccc(Cl)cc1O | 2 | 2 |
| mol10064 | O=c1ccc(Cl)ccc1O | 2 | 2 |
| mol10065 | O=c1ccccc(Br)c1O | 2 | 2 |
| mol10066 | O=c1cccc(Br)cc1O | 2 | 2 |
| mol10067 | O=c1ccc(Br)ccc1O | 2 | 2 |
| mol10068 | O=Cc1cccc([N+](=O)[O-])c1 | 0 | 0 |
| mol10069 | O=C(O)c1c(O)cccc1Cl | 2 | 2 |
| mol10070 | O=C(O)c1ccc(O)c(Cl)c1 | 3 | 3 |
| mol10071 | O=C(OO)c1ccccc1Cl | 2 | 2 |
| mol10072 | O=C(OO)c1cccc(Cl)c1 | 2 | 2 |
| mol10073 | O=C(OO)c1ccc(Cl)cc1 | 2 | 2 |
| mol10074 | O=C(O)c1cccc(Br)c1O | 3 | 3 |
| mol10075 | O=C(O)c1cc(Br)ccc1O | 3 | 3 |
| mol10076 | O=C(O)c1ccc(Br)cc1O | 2 | 2 |
| mol10077 | O=C1OI(O)c2ccccc21 | 0 | 0 |
| mol10078 | O=C(O)c1cccc(I)c1O | 2 | 2 |
| mol10079 | O=C(O)c1ccc(I)cc1O | 3 | 3 |
| mol10080 | O=C(O)c1cc(I)ccc1O | 2 | 2 |