Ethanol → HCID 22633476, compound
Reaction equation
[CH2:1]([CH3:2])[O:3][C:4]([C:5]([CH3:6])([CH3:7])[O:8][c:9]1[cH:10][cH:11][c:12]([O:15][CH2:16][CH2:17][c:18]2[n:19][c:20](-[c:24]3[cH:25][cH:26][c:27](-[c:30]4[c:31]([F:37])[cH:32][cH:33][cH:34][c:35]4[F:36])[cH:28][cH:29]3)[o:21][c:22]2[CH3:23])[cH:13][cH:14]1)=[O:38].[CH2:44]1[O:45][CH2:46][CH2:47][CH2:48]1.[CH3:41][CH2:42][OH:43].[Na+:40].[OH-:39]>>[O:3]=[C:4]([C:5]([CH3:6])([CH3:7])[O:8][c:9]1[cH:10][cH:11][c:12]([O:15][CH2:16][CH2:17][c:18]2[n:19][c:20](-[c:24]3[cH:25][cH:26][c:27](-[c:30]4[c:31]([F:37])[cH:32][cH:33][cH:34][c:35]4[F:36])[cH:28][cH:29]3)[o:21][c:22]2[CH3:23])[cH:13][cH:14]1)[OH:38]Participants
6
Sources & evidence
- ORD record
- ord-3ead4052a4ed47fa87b5daa6d4c8e2ac
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
Reaction notes
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