Hexane → HCID 22935580, compound
Reaction equation
[CH3:36][CH2:37][CH2:38][CH2:39][CH2:40][CH3:41].[F:1][c:2]1[cH:3][cH:4][c:5]([C:8]2([OH:35])[C:9]([CH3:33])([CH3:34])[O:10][c:11]3[c:12]2[c:13]([CH3:32])[c:14]([N:19]2[CH2:20][CH2:21][N:22]([CH2:25][c:26]4[cH:27][cH:28][cH:29][cH:30][cH:31]4)[CH2:23][CH2:24]2)[c:15]([CH3:18])[c:16]3[CH3:17])[cH:6][n:7]1>>[F:1][c:2]1[cH:3][cH:4][c:5]([CH:8]2[C:9]([CH3:33])([CH3:34])[O:10][c:11]3[c:12]2[c:13]([CH3:32])[c:14]([N:19]2[CH2:20][CH2:21][N:22]([CH2:25][c:26]4[cH:27][cH:28][cH:29][cH:30][cH:31]4)[CH2:23][CH2:24]2)[c:15]([CH3:18])[c:16]3[CH3:17])[cH:6][n:7]1Participants
3
Sources & evidence
- ORD record
- ord-ee5a635954104099baf58eafbd9f4163
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
Reaction notes
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