Water → HCID 71008039, compound

HRID 1215594Notes

Reaction equation

HRID 1215594 reaction equation
[Br:1][c:2]1[c:3]([CH2:8][CH:9]2[O:10][c:11]3[c:12]([cH:15][c:16]4[c:17]([cH:18]3)[O:19][CH2:20][C:21]43[C:22](=[O:30])[CH2:23][c:24]4[cH:25][cH:26][cH:27][cH:28][c:29]43)[O:13][CH2:14]2)[n:4][cH:5][cH:6][cH:7]1.[CH3:35][N:36]1[CH2:37][CH2:38][CH2:39][C:40]1=[O:41].[Na:31][C:32]#[N:33].[Ni:48]([Cl:49])[Cl:50].[OH2:34].[OH2:42].[OH2:43].[OH2:44].[OH2:45].[OH2:46].[OH2:47]>>[c:2]1([C:32]#[N:33])[c:3]([CH2:8][CH:9]2[O:10][c:11]3[c:12]([cH:15][c:16]4[c:17]([cH:18]3)[O:19][CH2:20][C:21]43[C:22](=[O:30])[CH2:23][c:24]4[cH:25][cH:26][cH:27][cH:28][c:29]43)[O:13][CH2:14]2)[n:4][cH:5][cH:6][cH:7]1

Participants

6

Reactant 5

HCID 962Water7×HCID 13387N-methyl-2-pyrrolidoneHCID 24385Nickel DichlorideHCID 71008070HCID 71008070, compoundHCID 178511850HCID 178511850, compound

Product 1

HCID 71008039HCID 71008039, compound

Sources & evidence

ORD record
ord-8556493c016e47e0991b1bce4a337898
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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