Ethyl Acetate → HCID 68914777, compound

HRID 1138778Notes

Reaction equation

HRID 1138778 reaction equation
[CH2:18]([CH2:19][CH2:20][CH2:21][CH3:22])[CH:23]1[CH2:24][CH:25]2[CH2:26][CH2:27][CH:28]([CH2:29]1)[NH:30]2.[CH3:31][CH2:32][CH2:33][CH2:34][CH2:35][CH2:36][CH3:37].[CH3:38][CH2:39][O:40][C:41]([CH3:42])=[O:43].[F:1][c:2]1[cH:3][c:4]2[c:5]([cH:16][cH:17]1)[N:6]([CH2:11][CH:12]([CH2:13][I:14])[CH3:15])[C:7](=[O:10])[CH2:8][O:9]2>>[F:1][c:2]1[cH:3][c:4]2[c:5]([cH:16][cH:17]1)[N:6]([CH2:11][CH:12]([CH2:13][N:30]1[CH:25]3[CH2:24][CH:23]([CH2:18][CH2:19][CH2:20][CH2:21][CH3:22])[CH2:29][CH:28]1[CH2:27][CH2:26]3)[CH3:15])[C:7](=[O:10])[CH2:8][O:9]2

Participants

5

Reactant 4

HCID 8857Ethyl AcetateHCID 8900HeptaneHCID 219898523-Pentyl-8-azabicyclo[3.2.1]octaneHCID 68915304HCID 68915304, compound

Product 1

HCID 68914777HCID 68914777, compound

Sources & evidence

ORD record
ord-aa6c3602a2e545bd8d0673dc6d15d684
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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