Ethanol → HCID 23498920, compound

HRID 1122832Notes

Reaction equation

HRID 1122832 reaction equation
[CH3:27][CH2:28][OH:29].[H:25][H:26].[n:1]1[c:2]([C:7]#[C:8][c:9]2[c:10]([CH:23]=[O:24])[cH:11][c:12]3[c:17]([cH:18]2)[C:16]([CH3:19])([CH3:20])[CH2:15][CH2:14][C:13]3([CH3:21])[CH3:22])[n:3][cH:4][cH:5][cH:6]1>>[n:1]1[c:2]([CH2:7][CH2:8][c:9]2[c:10]([CH:23]=[O:24])[cH:11][c:12]3[c:17]([cH:18]2)[C:16]([CH3:19])([CH3:20])[CH2:15][CH2:14][C:13]3([CH3:21])[CH3:22])[n:3][cH:4][cH:5][cH:6]1

Participants

4

Reactant 3

HCID 702EthanolHCID 23498911HCID 23498911, compoundHCID 178418361HCID 178418361, compound

Product 1

HCID 23498920HCID 23498920, compound

Sources & evidence

ORD record
ord-c38d84209351415bb98c6e5534566fec
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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