| Molecule ID | SMILES | Charge States | Microspecies |
|---|---|---|---|
| mol12881 | CC(C)CN(CCS)CC(C)C | 2 | 3 |
| mol12882 | CCN(CC)CCSCC(C)C | 2 | 2 |
| mol12883 | CCCCN(CCS)CCCC | 3 | 4 |
| mol12884 | C=C(C)C(=O)OCCNC(C)C | 2 | 2 |
| mol12885 | CC(O)CN(CC(C)O)C(C)C | 2 | 2 |
| mol12886 | C=C(C)C(=O)OC(C)CN(C)C | 2 | 2 |
| mol12887 | C=CC(=O)OCCN(CC)CC | 2 | 2 |
| mol12888 | CCCCCCNCCC(=O)O | 3 | 3 |
| mol12889 | NCCCCCCCCC(=O)O | 3 | 3 |
| mol12890 | NCCC#CC#CCCC(=O)O | 3 | 3 |
| mol12891 | CC(C)C(=O)C(C)(C)CN(C)C | 2 | 2 |
| mol12892 | C=CCC(C)(O)CN(CC)CC | 2 | 2 |
| mol12893 | NC(=O)C#CC#C/C=C/C(=O)O | 2 | 2 |
| mol12894 | N#CC(C#N)=C(N)C(C#N)C#N | 0 | 0 |
| mol12895 | CN(C)CC(CSC#N)SC#N | 2 | 2 |
| mol12896 | CN(C)/N=C(\N)CC[Si](C)(C)C | 2 | 3 |
| mol12897 | NC(=O)NOCCC(N)C(=O)O | 4 | 5 |
| mol12898 | CNC(=O)CS(=O)(=O)NC(N)=O | 2 | 2 |
| mol12899 | CC(C(N)=O)S(=O)(=O)NC(N)=O | 2 | 2 |
| mol12900 | CN(C)CCCNC(=O)/C=N/O | 3 | 4 |