Bicarbonate Ion → 2,3,4,5-Tetrahydro-1-benzoxepin-4-one
Reaction equation
[C:17](=[O:18])([OH:19])[O-:20].[CH3:12][CH2:13][O:14][CH2:15][CH3:16].[Na+:21].[O:1]1[CH2:2][CH2:3][C:4](=[O:11])[c:5]2[cH:6][cH:7][cH:8][cH:9][c:10]21>>[O:1]1[CH2:2][CH2:3][C:4](=[O:11])[CH2:12][c:5]2[cH:6][cH:7][cH:8][cH:9][c:10]21Participants
5
Sources & evidence
- ORD record
- ord-f09c5563b0a243d08d9f43f086068035
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Reaction notes
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