Acetonitrile → Bromide ion

HRID 665371Notes

Reaction equation

HRID 665371 reaction equation
[Br:1][CH2:2][C:3](=[O:4])[NH:5][c:6]1[c:7]([F:13])[cH:8][cH:9][cH:10][c:11]1[F:12].[CH3:38][C:39]#[N:40].[N:14]12[CH2:15][CH:16]([O:22][C:23](=[O:24])[C:25]3([c:32]4[cH:33][cH:34][cH:35][cH:36][cH:37]4)[CH2:26][CH2:27][CH2:28][CH2:29][CH2:30][CH2:31]3)[CH:17]([CH2:18][CH2:19]1)[CH2:20][CH2:21]2>>[Br-:1].[CH2:2]([C:3](=[O:4])[NH:5][c:6]1[c:7]([F:13])[cH:8][cH:9][cH:10][c:11]1[F:12])[N+:14]12[CH2:15][CH:16]([O:22][C:23](=[O:24])[C:25]3([c:32]4[cH:33][cH:34][cH:35][cH:36][cH:37]4)[CH2:26][CH2:27][CH2:28][CH2:29][CH2:30][CH2:31]3)[CH:17]([CH2:18][CH2:19]1)[CH2:20][CH2:21]2

Participants

5

Reactant 3

HCID 6342AcetonitrileHCID 606517911196093-39-6HCID 668858941-Azabicyclo[2.2.2]octan-3-yl 1-phenylcycloheptane-1-carboxylate

Product 2

HCID 259Bromide ionHCID 178521159HCID 178521159, compound

Sources & evidence

ORD record
ord-67f7fab7a9c743a19e8ddd8152ffa4ad
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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