Hexane → HCID 13628732, compound
Reaction equation
[CH3:26][CH2:27][CH2:28][CH2:29][CH2:30][CH3:31].[n:1]1[n:2](-[c:10]2[c:11]([OH:25])[c:12]([CH:17]([CH:18]=[CH2:19])[CH2:20][CH2:21][CH2:22][CH2:23][CH3:24])[cH:13][c:14]([CH3:16])[cH:15]2)[n:3][c:4]2[c:5]1[cH:6][cH:7][cH:8][cH:9]2>>[n:1]1[n:2](-[c:10]2[c:11]([OH:25])[c:12]([CH:17]([CH2:18][CH3:19])[CH2:20][CH2:21][CH2:22][CH2:23][CH3:24])[cH:13][c:14]([CH3:16])[cH:15]2)[n:3][c:4]2[c:5]1[cH:6][cH:7][cH:8][cH:9]2Participants
3
Sources & evidence
- ORD record
- ord-ac1ae46990734d58b2b327d3d57c3873
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
Reaction notes
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