| Molecule ID | SMILES | Charge States | Microspecies |
|---|---|---|---|
| mol27141 | N#CCC(N)=O | 2 | 3 |
| mol27142 | CCC(=O)NC | 2 | 2 |
| mol27143 | CONC(C)=O | 0 | 0 |
| mol27144 | COCC(N)=O | 0 | 0 |
| mol27145 | O=C1C=CC(=O)N1 | 2 | 2 |
| mol27146 | CC1(C)CC(=O)N1 | 0 | 0 |
| mol27147 | O=C1CCCCN1 | 2 | 2 |
| mol27148 | S=C1CCCN1 | 0 | 0 |
| mol27149 | CC(=O)NC(C)=O | 2 | 2 |
| mol27150 | CCC(=O)N(C)C | 2 | 2 |
| mol27151 | CC(C)CC(N)=O | 0 | 0 |
| mol27152 | CCN(C=O)CC | 0 | 0 |
| mol27153 | CNC(=O)C(C)C | 2 | 2 |
| mol27154 | O=C1C=CCC(=O)N1 | 0 | 0 |
| mol27155 | O=C1CCCCCN1 | 2 | 2 |
| mol27156 | NC(=O)[C@@H]1CCCN1 | 0 | 0 |
| mol27157 | Cn1c(=O)[nH][nH]c1=O | 2 | 2 |
| mol27158 | Cn1[nH]c(=O)[nH]c1=O | 2 | 3 |
| mol27159 | S=C1CCCCN1 | 0 | 0 |
| mol27160 | CC(C)C(=O)N(C)C | 0 | 0 |