Water → HCID 53839973, compound

HRID 1222890Notes

Reaction equation

HRID 1222890 reaction equation
[CH3:1][O:2][c:3]1[c:4]([O:14][S:15]([C:16]([F:17])([F:18])[F:19])(=[O:20])=[O:21])[c:5]2[cH:6][n:7][nH:8][c:9](=[O:13])[c:10]2[cH:11][cH:12]1.[CH3:30][CH2:31][N:32]([CH2:33][CH3:34])[CH2:35][CH3:36].[O:38]=[CH:39][N:40]([CH3:41])[CH3:42].[OH2:37].[c:22]1([C:28]#[CH:29])[cH:23][cH:24][cH:25][cH:26][cH:27]1>>[CH3:1][O:2][c:3]1[c:4]([C:29]#[C:28][c:22]2[cH:23][cH:24][cH:25][cH:26][cH:27]2)[c:5]2[cH:6][n:7][nH:8][c:9](=[O:13])[c:10]2[cH:11][cH:12]1

Participants

6

Reactant 5

HCID 962WaterHCID 6228DimethylformamideHCID 8471TriethylamineHCID 10821PhenylacetyleneHCID 54160016HCID 54160016, compound

Product 1

HCID 53839973HCID 53839973, compound

Sources & evidence

ORD record
ord-b2e650643cb34c06a390ab1b94d15555
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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