Hydrogen Bromide → HCID 24890772, compound

HRID 2335362Notes

Reaction equation

HRID 2335362 reaction equation
[BrH:1].[CH2:16]1[CH:17]2[CH2:18][C:19]3([C:25](=[O:26])[OH:27])[CH2:20][CH:21]([CH2:22][CH:23]13)[CH2:24]2.[CH3:2][O:3][CH2:4][CH2:5][n:6]1[c:7](=[NH:15])[s:8][c:9]2[c:10]1[CH2:11][CH2:12][CH2:13][CH2:14]2.[CH3:52][CH2:53][N:54]([CH2:55][CH3:56])[CH2:57][CH3:58].[O:59]=[CH:60][N:61]([CH3:62])[CH3:63].[P-:28]([F:29])([F:30])([F:31])([F:32])([F:33])[F:34].[n:35]1([O:36][C:37]([N:38]([CH3:39])[CH3:40])=[N+:41]([CH3:42])[CH3:43])[c:44]2[n:45][cH:46][cH:47][cH:48][c:49]2[n:50][n:51]1>>[CH3:2][O:3][CH2:4][CH2:5][n:6]1[c:7](=[N:15][C:25]([C:19]23[CH2:18][CH:17]4[CH2:16][CH:23]2[CH2:22][CH:21]([CH2:20]3)[CH2:24]4)=[O:26])[s:8][c:9]2[c:10]1[CH2:11][CH2:12][CH2:13][CH2:14]2

Participants

8

Reactant 7

HCID 260Hydrogen BromideHCID 6228DimethylformamideHCID 8471TriethylamineHCID 9886HexafluorophosphateHCID 2733865Hexahydro-2,5-methanopentalene-3a(1H)-carboxylic acidHCID 4641409(Dimethylamino)-N,N-dimethyl(3H-(1,2,3)triazolo(4,5-b)pyridin-3-yloxy)methaniminiumHCID 66859029HCID 66859029, compound

Product 1

HCID 24890772HCID 24890772, compound

Sources & evidence

ORD record
ord-ca5052f5b9a34ac196a4984a13dc10dd
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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