Acetate → 4-(3,3-Dimethylbut-1-yn-1-yl)benzaldehyde

Reaction equation

[Br:1][c:2]1[cH:3][cH:4][c:5]([CH:6]=[O:7])[cH:8][cH:9]1.[CH3:29][C:30]([C:31]#[CH:32])([CH3:33])[CH3:34].[CH3:35][CH2:36][N:37]([CH2:38][CH3:39])[CH2:40][CH3:41].[O-:43][C:44]([CH3:45])=[O:46].[O-:47][C:48]([CH3:49])=[O:50].[Pd+2:42].[c:10]1([P:11]([c:12]2[cH:13][cH:14][cH:15][cH:16][cH:17]2)[c:18]2[cH:19][cH:20][cH:21][cH:22][cH:23]2)[cH:24][cH:25][cH:26][cH:27][cH:28]1>>[c:2]1([C:32]#[C:31][C:30]([CH3:29])([CH3:33])[CH3:34])[cH:3][cH:4][c:5]([CH:6]=[O:7])[cH:8][cH:9]1

Participants

Reactant 6

HCID 175Acetate2×

HCID 8471Triethylamine

HCID 11776Triphenylphosphine

HCID 135123,3-Dimethyl-1-butyne

HCID 707414-Bromobenzaldehyde

HCID 105144Allyl(1,3-bis(2,6-diisopropylphenyl)imidazol-2-ylidene)chloropalladium(II)

Product 1

Sources & evidence

ORD record: ord-53d56b4c007a4e45ae0e61a180ae5207
Source dataset: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D

Reaction notes

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