HuagongsheHuagongshe Chemistry Print Report · For research reference only
Ethanol → 1-Ethylisoquinoline
Participants
| Role | Name | HCID | Charge |
|---|---|---|---|
| Reactant | Ethanol | HCID 702 | — |
| Reactant | Methanesulfonic Acid | HCID 6395 | — |
| Reactant | Isoquinoline | HCID 8405 | — |
| Reagent | Ethyl 2-mercaptopropionate | HCID 519709 | — |
| Solvent | Acetonitrile | HCID 6342 | — |
| Product | 1-Ethylisoquinoline | HCID 593686 | — |
| Internal standard | 9-Phenylanthracene | HCID 11766 | — |
Reaction Conditions
| Temperature | 25 °C |
|---|
Provenance & Evidence
| DOI | 10.1038/s41557 |
|---|---|
| Source dataset | 39k HTE dataset from Pfizer |
| ORD ID | ord-d209a4cdbc7240e19b6276a2a9627d8a |
| Source note | 39k HTE dataset from Pfizer |