Acetate → HCID 68892424, compound

HRID 2321443Notes

Reaction equation

HRID 2321443 reaction equation
[C:12](#[N:13])[CH2:14][C:15](=[O:16])[O:17][CH2:18][CH3:19].[CH3:21][C:22](=[O:23])[O-:24].[CH3:25][C:26](=[O:27])[OH:28].[CH3:35][CH2:36][O:37][C:38](=[O:39])[CH3:40].[F:1][c:2]1[cH:3][c:4]2[c:8]([cH:9][cH:10]1)[C:7](=[O:11])[CH2:6][CH2:5]2.[NH4+:20].[OH2:41].[cH:29]1[cH:30][cH:31][cH:32][cH:33][cH:34]1>>[F:1][c:2]1[cH:3][c:4]2[c:8]([cH:9][cH:10]1)[C:7](=[C:14]([C:12]#[N:13])[C:15](=[O:16])[O:17][CH2:18][CH3:19])[CH2:6][CH2:5]2

Participants

9

Reactant 8

HCID 175AcetateHCID 176Acetic AcidHCID 223AmmoniumHCID 241BenzeneHCID 962WaterHCID 7764Ethyl cyanoacetateHCID 8857Ethyl AcetateHCID 1365375-Fluoro-1-indanone

Product 1

HCID 68892424HCID 68892424, compound

Sources & evidence

ORD record
ord-b9abbb3112a44d7491378c5afc669aca
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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