Toluene → HCID 178441246, compound
Reaction equation
[C:1]([CH3:2])([CH3:3])([CH3:4])[CH:5]1[CH:6]([O:16][SiH:17]([c:18]2[cH:19][cH:20][cH:21][cH:22][cH:23]2)[c:24]2[cH:25][cH:26][cH:27][cH:28][cH:29]2)[N:7]([c:9]2[s:10][cH:11][c:12]([CH2:14][OH:15])[n:13]2)[CH2:8]1.[CH3:66][c:67]1[cH:68][cH:69][cH:70][cH:71][cH:72]1.[O:73]1[CH2:74][CH2:75][CH2:76][CH2:77]1.[c:30]1([P:31]([c:32]2[cH:33][cH:34][cH:35][cH:36][cH:37]2)(=[O:38])[N:44]=[N+:45]=[N-:46])[cH:39][cH:40][cH:41][cH:42][cH:43]1.[c:47]1([P:48]([c:49]2[cH:50][cH:51][cH:52][cH:53][cH:54]2)[c:55]2[cH:56][cH:57][cH:58][cH:59][cH:60]2)[cH:61][cH:62][cH:63][cH:64][cH:65]1>>[C:1]([CH3:2])([CH3:3])([CH3:4])[CH:5]1[CH:6]([O:16][SiH:17]([c:18]2[cH:19][cH:20][cH:21][cH:22][cH:23]2)[c:24]2[cH:25][cH:26][cH:27][cH:28][cH:29]2)[N:7]([c:9]2[s:10][cH:11][c:12]([CH2:14][N:44]=[N+:45]=[N-:46])[n:13]2)[CH2:8]1Participants
6
Sources & evidence
- ORD record
- ord-8c36d12c95aa420782dfa16fe97916c0
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Reaction notes
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