Acetate → HCID 54354862, compound
Reaction equation
[CH3:29][C:30](=[O:31])[O-:32].[CH3:51][C:52]#[N:53].[CH:1](=[O:2])[c:3]1[c:4]([CH3:27])[n:5][c:6]2[n:7]1[cH:8][cH:9][cH:10][c:11]2[O:12][CH:13]1[CH:14]([O:22][S:23]([CH3:24])(=[O:25])=[O:26])[CH2:15][c:16]2[cH:17][cH:18][cH:19][cH:20][c:21]21.[Cl:54][CH2:55][Cl:56].[K+:28].[O:33]1[CH2:34][CH2:35][O:36][CH2:37][CH2:38][O:39][CH2:40][CH2:41][O:42][CH2:43][CH2:44][O:45][CH2:46][CH2:47][O:48][CH2:49][CH2:50]1>>[CH:1](=[O:2])[c:3]1[c:4]([CH3:27])[n:5][c:6]2[n:7]1[cH:8][cH:9][cH:10][c:11]2[O:12][CH:13]1[CH:14]([OH:22])[CH2:15][c:16]2[cH:17][cH:18][cH:19][cH:20][c:21]21Participants
7
Sources & evidence
- ORD record
- ord-fb394f7206e441c0ae2939601e9b53d1
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
Reaction notes
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