Bromide ion → HCID 178429027, compound
Reaction equation
[Br-:62].[Br:54][CH2:55][CH2:56][CH2:57][Cl:58].[CH2:63]([N+:64]([CH2:65][CH2:66][CH2:67][CH3:68])([CH2:69][CH2:70][CH2:71][CH3:72])[CH2:73][CH2:74][CH2:75][CH3:76])[CH2:77][CH2:78][CH3:79].[ClH:61].[Na+:60].[O:80]1[CH2:81][CH2:82][CH2:83][CH2:84]1.[OH-:59].[OH:1][c:2]1[cH:3][c:4]([CH3:53])[c:5]([CH2:8][c:9]2[c:10]([O:17][CH:18]3[CH:19]([O:20][C:21]([C:22]([CH3:23])([CH3:24])[CH3:25])=[O:26])[CH:27]([O:28][C:29]([C:30]([CH3:31])([CH3:32])[CH3:33])=[O:34])[CH:35]([O:36][C:37]([C:38]([CH3:39])([CH3:40])[CH3:41])=[O:42])[CH:43]([CH2:45][O:46][C:47]([C:48]([CH3:49])([CH3:50])[CH3:51])=[O:52])[O:44]3)[n:11][nH:12][c:13]2[CH:14]([CH3:15])[CH3:16])[cH:6][cH:7]1>>[O:1]([c:2]1[cH:3][c:4]([CH3:53])[c:5]([CH2:8][c:9]2[c:10]([O:17][CH:18]3[CH:19]([O:20][C:21]([C:22]([CH3:23])([CH3:24])[CH3:25])=[O:26])[CH:27]([O:28][C:29]([C:30]([CH3:31])([CH3:32])[CH3:33])=[O:34])[CH:35]([O:36][C:37]([C:38]([CH3:39])([CH3:40])[CH3:41])=[O:42])[CH:43]([CH2:45][O:46][C:47]([C:48]([CH3:49])([CH3:50])[CH3:51])=[O:52])[O:44]3)[n:11][nH:12][c:13]2[CH:14]([CH3:15])[CH3:16])[cH:6][cH:7]1)[CH2:55][CH2:56][CH2:57][Cl:58]Participants
9
Sources & evidence
- ORD record
- ord-461d7c4080424169b8f7caa6a580d620
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (6/10)
Reaction notes
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