| Molecule ID | SMILES | Charge States | Microspecies |
|---|---|---|---|
| mol9301 | O=C1C=CC(=O)C1 | 0 | 0 |
| mol9302 | C#C/C=C/C(=O)O | 2 | 2 |
| mol9303 | O=c1ccocc1O | 2 | 2 |
| mol9304 | O=c1c(O)cocc1O | 3 | 3 |
| mol9305 | O=C1CCC=C1O | 2 | 3 |
| mol9306 | OCc1ccco1 | 2 | 3 |
| mol9307 | CCC#CC(=O)O | 2 | 2 |
| mol9308 | CC#CCC(=O)O | 2 | 2 |
| mol9309 | C#CCCC(=O)O | 2 | 2 |
| mol9310 | CC1=C(O)C(=O)OC1 | 2 | 2 |
| mol9311 | CC1=C(O)COC1=O | 0 | 0 |
| mol9312 | CC(=O)/C=C/C(=O)O | 2 | 2 |
| mol9313 | C=C(CC(=O)O)C(=O)O | 3 | 4 |
| mol9314 | C/C(=C/C(=O)O)C(=O)O | 3 | 4 |
| mol9315 | O=C(O)[C@H]1C[C@H]1C(=O)O | 3 | 3 |
| mol9316 | O=C(O)[C@@H]1C[C@H]1C(=O)O | 3 | 3 |
| mol9317 | O=C(O)C1CCOC1=O | 2 | 2 |
| mol9318 | Cn1cnc2nn[nH]c2c1=N | 3 | 7 |
| mol9319 | CC(C)=CC(=O)O | 2 | 2 |
| mol9320 | C[C@H]1C[C@H]1C(=O)O | 2 | 2 |