Hexanal → HCID 57554577, compound

HRID 1145962Notes

Reaction equation

HRID 1145962 reaction equation
[CH3:1][C:2]1([CH3:33])[O:3][C:4](=[O:32])[c:5]2[c:6]([cH:8][cH:9][c:10]([NH:12][CH2:13][c:14]3[cH:15][cH:16][c:17]([C:20]#[C:21][c:22]4[cH:23][cH:24][c:25]([C:28]([F:29])([F:30])[F:31])[cH:26][cH:27]4)[cH:18][cH:19]3)[cH:11]2)[O:7]1.[CH:34]([CH2:35][CH2:36][CH2:37][CH2:38][CH3:39])=[O:40]>>[CH3:1][C:2]1([CH3:33])[O:3][C:4](=[O:32])[c:5]2[c:6]([cH:8][cH:9][c:10]([N:12]([CH2:13][c:14]3[cH:15][cH:16][c:17]([C:20]#[C:21][c:22]4[cH:23][cH:24][c:25]([C:28]([F:29])([F:30])[F:31])[cH:26][cH:27]4)[cH:18][cH:19]3)[CH2:34][CH2:35][CH2:36][CH2:37][CH2:38][CH3:39])[cH:11]2)[O:7]1

Participants

3

Reactant 2

HCID 6184HexanalHCID 57554502HCID 57554502, compound

Product 1

HCID 57554577HCID 57554577, compound

Sources & evidence

ORD record
ord-a651d3d0ba564ccb922658067bb1a990
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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