Ethylene Glycol → 6-(7-Hydroxyheptyl)-1,4-dioxaspiro[4.4]nonane-7-carbonitrile
Reaction equation
[Na+:32].[Na+:33].[O-:34][C:35](=[O:36])[O-:37].[OH2:38].[OH:17][CH2:18][CH2:19][OH:20].[OH:1][CH2:2][CH2:3][CH2:4][CH2:5][CH2:6][CH2:7][CH2:8][CH:9]1[CH:10]([C:15]#[N:16])[CH2:11][CH2:12][C:13]1=[O:14].[c:21]1([CH3:22])[cH:23][cH:24][c:25]([S:26]([OH:27])(=[O:28])=[O:29])[cH:30][cH:31]1.[cH:39]1[cH:40][cH:41][cH:42][cH:43][cH:44]1>>[OH:1][CH2:2][CH2:3][CH2:4][CH2:5][CH2:6][CH2:7][CH2:8][CH:9]1[CH:10]([C:15]#[N:16])[CH2:11][CH2:12][C:13]12[O:14][CH2:19][CH2:18][O:17]2Participants
8
Sources & evidence
- ORD record
- ord-cc62b82ef49e4078920b49c5c07a7714
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
Reaction notes
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