Hexane → Bromide ion

HRID 696466Notes

Reaction equation

HRID 696466 reaction equation
[CH3:33][CH2:34][O:35][C:36](=[O:37])[CH3:38].[CH3:39][CH2:40][CH2:41][CH2:42][CH2:43][CH3:44].[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.[c:23]1([O:29][CH2:30][CH2:31][Br:32])[cH:24][cH:25][cH:26][cH:27][cH:28]1>>[Br-:32].[N+:1]12([CH2:31][CH2:30][O:29][c:23]3[cH:24][cH:25][cH:26][cH:27][cH:28]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 8058HexaneHCID 8857Ethyl AcetateHCID 68526Benzene, (2-bromoethoxy)-HCID 239923851-Azabicyclo[2.2.2]oct-4-yl(diphenyl)methanol

Product 2

HCID 259Bromide ionHCID 11705920HCID 11705920, compound

Sources & evidence

ORD record
ord-f93fc968c9f145f69244abaf00cf236a
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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