Participants
| Role | Name | HCID | Charge |
|---|
| Reactant | Acetate | HCID 175 | — |
| Reactant | Acetic Acid | HCID 176 | — |
| Reactant | Ethanol | HCID 702 | — |
| Reactant | Sodium ion | HCID 923 | — |
| Reactant | Nitrite | HCID 946 | — |
| Reactant | Sulfuric Acid | HCID 1118 | — |
| Reactant | Ethyl Acetoacetate | HCID 8868 | — |
| Reactant | 4-Amino-3,5-dichlorobenzotrifluoride | HCID 141094 | — |
| Product | HCID 178472852 | HCID 178472852 | — |
Provenance & Evidence
| DOI | 10.1039/C8SC04228D |
|---|
| Source dataset | Training data from https://doi.org/10.1039/C8SC04228D (10/10) |
|---|
| ORD ID | ord-38c4dcda2c884e61898478f3025ff41a |
|---|
| Source note | Training data from https://doi.org/10.1039/C8SC04228D (10/10) |
|---|
