Bromide ion → HCID 54343743, compound

HRID 1114975Notes

Reaction equation

HRID 1114975 reaction equation
[Br-:1].[CH2:37]([CH2:38][CH2:39][CH3:40])[O:41][C:42]([CH:43]=[C:44]([CH:45]=[CH:46][CH:47]=[C:48]([CH3:49])[CH:50]=[O:51])[CH3:52])=[O:53].[CH:2]([CH3:3])([CH3:4])[c:5]1[c:6]([CH2:7][P+:8]([c:9]2[cH:10][cH:11][cH:12][cH:13][cH:14]2)([c:15]2[cH:16][cH:17][cH:18][cH:19][cH:20]2)[c:21]2[cH:22][cH:23][cH:24][cH:25][cH:26]2)[c:27]([CH:34]([CH3:35])[CH3:36])[cH:28][c:29]([CH:31]([CH3:32])[CH3:33])[cH:30]1>>[CH:2]([CH3:3])([CH3:4])[c:5]1[c:6]([CH:7]=[CH:50][C:48](=[CH:47][CH:46]=[CH:45][C:44](=[CH:43][C:42]([O:41][CH2:37][CH2:38][CH2:39][CH3:40])=[O:53])[CH3:52])[CH3:49])[c:27]([CH:34]([CH3:35])[CH3:36])[cH:28][c:29]([CH:31]([CH3:32])[CH3:33])[cH:30]1

Participants

4

Reactant 3

HCID 259Bromide ionHCID 53845956Butyl 3,7-dimethyl-8-oxoocta-2,4,6-trienoateHCID 86735896HCID 86735896, compound

Product 1

HCID 54343743HCID 54343743, compound

Sources & evidence

ORD record
ord-0944b464e6aa4f20b4a36916c48d2a93
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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