| Molecule ID | SMILES | Charge States | Microspecies |
|---|---|---|---|
| mol31061 | N#CCO | 2 | 2 |
| mol31062 | C=C(C)O | 0 | 0 |
| mol31063 | C/C=C/O | 0 | 0 |
| mol31064 | C=C(N)O | 0 | 0 |
| mol31065 | C=C(O)O | 0 | 0 |
| mol31066 | CNCO | 2 | 2 |
| mol31067 | COCO | 2 | 2 |
| mol31068 | CC(O)O | 2 | 2 |
| mol31069 | C/C=C(\C)O | 0 | 0 |
| mol31070 | CC(C)=CO | 0 | 0 |
| mol31071 | CCOCO | 2 | 2 |
| mol31072 | CC(C)(O)O | 0 | 0 |
| mol31073 | CCSO | 2 | 1 |
| mol31074 | CSCO | 0 | 0 |
| mol31075 | COC(O)O | 2 | 2 |
| mol31076 | OC1=CCCC1 | 0 | 0 |
| mol31077 | O=c1c(O)c1O | 2 | 2 |
| mol31078 | CC(C)=C(C)O | 0 | 0 |
| mol31079 | C/C=C(\O)CC | 0 | 0 |
| mol31080 | C=C(O)OCC | 2 | 1 |