Chloride → 2-[(3,5-Dimethyl-4-phenylmethoxyphenyl)methylidene]-1,4-dioxaspiro[4.5]decan-3-one

HRID 91134

Reaction equation

HRID 91134 reaction equation
[C:53]([O:54][CH3:55])([CH3:56])([CH3:57])[CH3:58].[CH2:3]([c:4]1[cH:5][cH:6][cH:7][cH:8][cH:9]1)[O:10][c:11]1[c:12]([CH3:20])[cH:13][c:14]([CH:15]=[O:16])[cH:17][c:18]1[CH3:19].[CH3:40][NH:41][C:42](=[N:43][CH3:44])[N:45]([CH3:46])[CH3:47].[Cl-:2].[Li+:1].[O:21]=[C:22]1[CH:23]([P:32](=[O:33])([O:34][CH2:35][CH3:36])[O:37][CH2:38][CH3:39])[O:24][C:25]2([O:26]1)[CH2:27][CH2:28][CH2:29][CH2:30][CH2:31]2.[O:48]1[CH2:49][CH2:50][CH2:51][CH2:52]1>>[CH2:3]([c:4]1[cH:5][cH:6][cH:7][cH:8][cH:9]1)[O:10][c:11]1[c:12]([CH3:20])[cH:13][c:14]([CH:15]=[C:23]2[C:22](=[O:21])[O:26][C:25]3([O:24]2)[CH2:27][CH2:28][CH2:29][CH2:30][CH2:31]3)[cH:17][c:18]1[CH3:19]

Participants

8

Reactant 7

HCID 312ChlorideHCID 8028TetrahydrofuranHCID 15413tert-Butyl methyl etherHCID 28486Lithium ionHCID 141618N,N,N',N''-TetramethylguanidineHCID 5635574-(Benzyloxy)-3,5-dimethylbenzaldehydeHCID 59259703Diethyl(3-oxo-1,4-dioxaspiro[4.5]dec-2-yl)-phosphonate

Product 1

HCID 667575752-[(3,5-Dimethyl-4-phenylmethoxyphenyl)methylidene]-1,4-dioxaspiro[4.5]decan-3-one

Sources & evidence

ORD record
ord-2d90ac6cffac4b548ff0936a99b6041f
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Linked notes

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