| Molecule ID | SMILES | Charge States | Microspecies |
|---|---|---|---|
| mol9961 | COC(=O)c1cocc1C(=O)O | 2 | 2 |
| mol9962 | COc1coc(C(=O)O)cc1=O | 2 | 2 |
| mol9963 | Cc1cccc(O)c1O | 3 | 4 |
| mol9964 | Cc1ccc(O)c(O)c1 | 3 | 4 |
| mol9965 | Cc1ccc(O)cc1O | 3 | 4 |
| mol9966 | Cc1cc(O)cc(O)c1 | 3 | 3 |
| mol9967 | Cc1cc(O)ccc1O | 3 | 4 |
| mol9968 | OCc1ccccc1O | 2 | 2 |
| mol9969 | OCc1cccc(O)c1 | 2 | 2 |
| mol9970 | OCc1ccc(O)cc1 | 2 | 2 |
| mol9971 | COc1ccccc1O | 2 | 2 |
| mol9972 | COc1cccc(O)c1 | 2 | 2 |
| mol9973 | COc1ccc(O)cc1 | 2 | 2 |
| mol9974 | COC(=O)C1=C(C(=O)O)CC1 | 2 | 2 |
| mol9975 | O=C(O)C1=C(C(=O)O)CCC1 | 0 | 0 |
| mol9976 | O=C(O)C1=CCC(C(=O)O)C1 | 3 | 4 |
| mol9977 | O=C(O)C1=CCCC1C(=O)O | 3 | 4 |
| mol9978 | O=C1C[C@H](C(=O)O)[C@H](C(=O)O)C1 | 3 | 3 |
| mol9979 | O=C1C[C@@H](C(=O)O)[C@H](C(=O)O)C1 | 3 | 3 |
| mol9980 | O=C(O)C12CCC(C1)C2 | 2 | 2 |