Acetone → HCID 59440146, compound
Reaction equation
[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[O:8][c:9]1[cH:10][c:11]([N+:35](=[O:36])[O-:37])[c:12]([C:13](=[O:14])[N:15]2[CH:16]([C:27](=[O:28])[O:29][CH3:30])[CH2:17][c:18]3[cH:19][cH:20][c:21]([N+:24](=[O:25])[O-:26])[cH:22][c:23]32)[cH:31][c:32]1[O:33][CH3:34].[CH3:38][C:39](=[O:40])[CH3:41].[CH3:42][CH:43]([CH2:44][AlH:45][CH2:46][CH:47]([CH3:48])[CH3:49])[CH3:50].[CH3:51][OH:52].[CH3:56][c:57]1[cH:58][cH:59][cH:60][cH:61][cH:62]1.[CH3:64][CH2:65][O:66][C:67](=[O:68])[CH3:69].[Cl:53][CH2:54][Cl:55].[ClH:63]>>[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[O:8][c:9]1[cH:10][c:11]([N+:35](=[O:36])[O-:37])[c:12]([C:13](=[O:14])[N:15]2[CH:16]([CH:27]=[O:28])[CH2:17][c:18]3[cH:19][cH:20][c:21]([N+:24](=[O:25])[O-:26])[cH:22][c:23]32)[cH:31][c:32]1[O:33][CH3:34]Participants
9
Sources & evidence
- ORD record
- ord-2f24c856f3414eb4a2ff44829c391a21
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
Reaction notes
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