Chloroform → Bromide ion

HRID 306867Notes

Reaction equation

HRID 306867 reaction equation
[Br:23][CH2:24][CH2:25][O:26][CH2:27][c:28]1[cH:29][cH:30][c:31]([C:32]#[N:33])[cH:34][cH:35]1.[CH3:36][C:37]#[N:38].[Cl:39][CH:40]([Cl:41])[Cl:42].[N:1]12[CH2:2][CH2:3][C:4]([C:9]([OH:10])([c:11]3[cH:12][cH:13][cH:14][cH:15][cH:16]3)[c:17]3[cH:18][cH:19][cH:20][cH:21][cH:22]3)([CH2:5][CH2:6]1)[CH2:7][CH2:8]2>>[Br-:23].[N+:1]12([CH2:24][CH2:25][O:26][CH2:27][c:28]3[cH:29][cH:30][c:31]([C:32]#[N:33])[cH:34][cH:35]3)[CH2:2][CH2:3][C:4]([C:9]([OH:10])([c:11]3[cH:12][cH:13][cH:14][cH:15][cH:16]3)[c:17]3[cH:18][cH:19][cH:20][cH:21][cH:22]3)([CH2:5][CH2:6]1)[CH2:7][CH2:8]2

Participants

6

Reactant 4

HCID 6212ChloroformHCID 6342AcetonitrileHCID 239923851-Azabicyclo[2.2.2]oct-4-yl(diphenyl)methanolHCID 67027645HCID 67027645, compound

Product 2

HCID 259Bromide ionHCID 115121194-[2-[4-[Hydroxy(diphenyl)methyl]-1-azoniabicyclo[2.2.2]octan-1-yl]ethoxymethyl]benzonitrile

Sources & evidence

ORD record
ord-a0ce60b1dea640c3a749fbd2d6481f71
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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