Ethanol → HCID 58999618, compound

HRID 1215943Notes

Reaction equation

HRID 1215943 reaction equation
[CH3:30][CH2:31][OH:32].[F:1][c:2]1[cH:3][c:4]2[c:5]3[c:10]([nH:11][c:12]2[cH:13][cH:14]1)[CH2:9][CH2:8][CH:7]([CH2:15][O:16][S:17]([c:18]1[cH:19][cH:20][c:21]([CH3:22])[cH:23][cH:24]1)(=[O:25])=[O:26])[CH2:6]3.[Na:27][C:28]#[N:29]>>[F:1][c:2]1[cH:3][c:4]2[c:5]3[c:10]([nH:11][c:12]2[cH:13][cH:14]1)[CH2:9][CH2:8][CH:7]([CH2:15][C:28]#[N:29])[CH2:6]3

Participants

4

Sources & evidence

ORD record
ord-7821509e69904e5ca9ebc441b30315be
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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