4,4-Dimethylpentanal → HCID 178438179, compound

HRID 286556Notes

Reaction equation

HRID 286556 reaction equation
[CH2:1]([CH3:2])[C:3]1([OH:29])[CH2:4][C:5](=[O:28])[O:6][CH2:7][c:8]2[c:9](=[O:27])[n:10]3[c:24]([cH:25][c:26]21)-[c:13]1[c:12]([cH:21][c:20]2[c:15]([n:14]1)[cH:16][c:17]([F:23])[cH:18][c:19]2[F:22])[CH2:11]3.[CH3:30][C:31]([CH2:32][CH2:33][CH:34]=[O:35])([CH3:36])[CH3:37]>>[CH2:1]([CH3:2])[C:3]1([OH:29])[CH2:4][C:5](=[O:28])[O:6][CH2:7][c:8]2[c:9](=[O:27])[n:10]3[c:24]([cH:25][c:26]21)-[c:13]1[c:12]([c:21]([CH2:33][CH2:32][C:31]([CH3:30])([CH3:36])[CH3:37])[c:20]2[c:15]([n:14]1)[cH:16][c:17]([F:23])[cH:18][c:19]2[F:22])[CH2:11]3

Participants

3

Reactant 2

HCID 110623434,4-DimethylpentanalHCID 178438182HCID 178438182, compound

Product 1

HCID 178438179HCID 178438179, compound

Sources & evidence

ORD record
ord-8bd584bac51f4c8bb4f80a00f9cc5868
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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