Toluene → HCID 23156127, compound
Reaction equation
[CH2:1]([CH3:2])[c:3]1[n:4][c:5]2[c:6]([n:7][c:8]([CH3:12])[cH:9][c:10]2[CH3:11])[n:13]1[CH2:14][c:15]1[cH:16][cH:17][c:18]([CH:19]([c:20]2[cH:21][cH:22][cH:23][cH:24][cH:25]2)[OH:26])[cH:27][cH:28]1.[CH2:46]1[CH2:47][CH2:48][C:49]2=[N:54][CH2:53][CH2:52][CH2:51][N:50]2[CH2:55][CH2:56]1.[CH3:57][c:58]1[cH:59][cH:60][cH:61][cH:62][cH:63]1.[c:29]1([P:30]([c:31]2[cH:32][cH:33][cH:34][cH:35][cH:36]2)(=[O:37])[N:43]=[N+:44]=[N-:45])[cH:38][cH:39][cH:40][cH:41][cH:42]1>>[CH2:1]([CH3:2])[c:3]1[n:4][c:5]2[c:6]([n:7][c:8]([CH3:12])[cH:9][c:10]2[CH3:11])[n:13]1[CH2:14][c:15]1[cH:16][cH:17][c:18]([CH:19]([c:20]2[cH:21][cH:22][cH:23][cH:24][cH:25]2)[N:43]=[N+:44]=[N-:45])[cH:27][cH:28]1Participants
5
Sources & evidence
- ORD record
- ord-90cf6c275bc141f0b857300a2275e0bf
- Source dataset
- Test data from https://doi.org/10.1039/C8SC04228D
Reaction notes
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