Participants
| Role | Name | HCID | Charge |
|---|
| Reactant | Sodium ion | HCID 923 | — |
| Reactant | Hydroxide | HCID 961 | — |
| Reactant | Water | HCID 962 | — |
| Reactant | Acetonitrile | HCID 6342 | — |
| Reactant | Borohydride | HCID 28123 | — |
| Reactant | 1,3-Dihydro-1-oxoisobenzofuran-5-carbonitrile | HCID 821218 | — |
| Reactant | 4-(4-Fluorobenzoyl)-3-(hydroxymethyl)benzonitrile | HCID 10945002 | — |
| Reactant | 4-(Bis(4-fluorophenyl)(hydroxy)methyl)-3-(hydroxymethyl)benzonitrile | HCID 69207115 | — |
| Product | ST069377 | HCID 9921362 | — |
Provenance & Evidence
| DOI | 10.1039/C8SC04228D |
|---|
| Source dataset | Training data from https://doi.org/10.1039/C8SC04228D (5/10) |
|---|
| ORD ID | ord-1e236ea61c5747c9aaab00cee8f60dd7 |
|---|
| Source note | Training data from https://doi.org/10.1039/C8SC04228D (5/10) |
|---|
