Participants
| Role | Name | HCID | Charge |
|---|
| Reactant | Ethanol | HCID 702 | — |
| Reactant | 2-Butenedioic acid | HCID 723 | — |
| Reactant | Dichloromethane | HCID 6344 | — |
| Reactant | Methyl chloroformate | HCID 6586 | — |
| Reactant | Diisopropyl Ether | HCID 7914 | — |
| Reactant | Triethylamine | HCID 8471 | — |
| Reactant | Butenedioate | HCID 164547 | — |
| Reactant | 2-(4-(6-Fluorobenzo[d]isoxazol-3-yl)piperidin-1-yl)ethan-1-amine | HCID 14699857 | — |
| Product | 2-Butenedioic acid | HCID 723 | — |
| Product | HCID 21758342 | HCID 21758342 | — |
Provenance & Evidence
| DOI | 10.1039/C8SC04228D |
|---|
| Source dataset | Training data from https://doi.org/10.1039/C8SC04228D (1/10) |
|---|
| ORD ID | ord-7e7d5d0845d04f809e0d056a2cde665f |
|---|
| Source note | Training data from https://doi.org/10.1039/C8SC04228D (1/10) |
|---|
