Participants
| Role | Name | HCID | Charge |
|---|
| Reactant | Chloride | HCID 312 | — |
| Reactant | Bicarbonate Ion | HCID 769 | — |
| Reactant | Methanol | HCID 887 | — |
| Reactant | Sodium ion | HCID 923 | — |
| Reactant | Dichloromethane | HCID 6344 | — |
| Reactant | Diisopropylethylamine | HCID 81531 | — |
| Reactant | Titanium cation (4+) | HCID 114942 | — |
| Reactant | 1,1,1-Trifluorobutan-2-one | HCID 238288 | — |
| Reactant | Cyano-borohydride | HCID 498716 | — |
| Reactant | tert-butyl 3-[[4-(2-aminoethyl)-2,2-dimethyl-3-oxo-7-(trifluoromethyl)-1,4-benzoxazine-6-carbonyl]-propan-2-ylamino]piperidine-1-carboxylate | HCID 178457623 | — |
| Product | HCID 178457370 | HCID 178457370 | — |
Provenance & Evidence
| DOI | 10.1039/C8SC04228D |
|---|
| Source dataset | Training data from https://doi.org/10.1039/C8SC04228D (3/10) |
|---|
| ORD ID | ord-5aaceda56a5e4d53ba804360d1f00e11 |
|---|
| Source note | Training data from https://doi.org/10.1039/C8SC04228D (3/10) |
|---|
