Acetic Acid → 4-(1-Methyl-2-phenylindol-3-yl)but-3-en-2-one

HRID 160865

Reaction equation

HRID 160865 reaction equation
[CH3:17][O:18][CH:19]([CH2:20][C:21]([CH3:22])=[O:23])[O:24][CH3:25].[CH3:1][n:2]1[c:3](-[c:11]2[cH:12][cH:13][cH:14][cH:15][cH:16]2)[cH:4][c:5]2[cH:6][cH:7][cH:8][cH:9][c:10]12.[CH3:27][C:28](=[O:29])[OH:30].[ClH:26]>>[CH3:1][n:2]1[c:3](-[c:11]2[cH:12][cH:13][cH:14][cH:15][cH:16]2)[c:4]([CH:19]=[CH:20][C:21]([CH3:22])=[O:23])[c:5]2[cH:6][cH:7][cH:8][cH:9][c:10]12

Participants

5

Reactant 4

HCID 176Acetic AcidHCID 313Hydrochloric AcidHCID 770951-Methyl-2-phenylindoleHCID 2285484,4-Dimethoxy-2-butanone

Product 1

HCID 671951064-(1-Methyl-2-phenylindol-3-yl)but-3-en-2-one

Sources & evidence

ORD record
ord-3da08ee77a9a4e4c90e8462af194b1b8
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Linked notes

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