Acetate → HCID 17978715, compound

HRID 1117202Notes

Reaction equation

HRID 1117202 reaction equation
[C:26](=[O:27])([OH:28])[O-:29].[CH3:16][CH2:17][N+:18](=[O:19])[O-:20].[CH3:22][C:23](=[O:24])[O-:25].[CH3:31][C:32](=[O:33])[OH:34].[Na+:21].[Na+:30].[OH2:35].[OH:1][c:2]1[c:3]([CH:4]=[O:5])[cH:6][cH:7][c:8](-[c:10]2[n:11][c:12]([CH3:15])[o:13][cH:14]2)[cH:9]1>>[OH:1][c:2]1[c:3]([C:4]#[N:18])[cH:6][cH:7][c:8](-[c:10]2[n:11][c:12]([CH3:15])[o:13][cH:14]2)[cH:9]1

Participants

8

Reactant 7

HCID 175AcetateHCID 176Acetic AcidHCID 769Bicarbonate IonHCID 923Sodium ion2×HCID 962WaterHCID 6587NitroethaneHCID 17978713HCID 17978713, compound

Product 1

HCID 17978715HCID 17978715, compound

Sources & evidence

ORD record
ord-17173ef6f53e436087290e7c0388f08f
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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