Acetonitrile → HCID 54019853, compound

HRID 164932Notes

Reaction equation

HRID 164932 reaction equation
[CH3:31][C:32]#[N:33].[CH:15]12[CH2:16][N:17]([C:24](=[O:25])[O:26][C:27]([CH3:28])([CH3:29])[CH3:30])[CH2:18][CH:19]([CH2:20][NH:21][CH2:22]1)[CH2:23]2.[O:1]1[CH:2]([CH2:4][CH2:5][O:6][c:7]2[cH:8][cH:9][c:10]([C:11]#[N:12])[cH:13][cH:14]2)[CH2:3]1>>[OH:1][CH:2]([CH2:3][N:21]1[CH2:20][CH:19]2[CH2:18][N:17]([C:24](=[O:25])[O:26][C:27]([CH3:28])([CH3:29])[CH3:30])[CH2:16][CH:15]([CH2:22]1)[CH2:23]2)[CH2:4][CH2:5][O:6][c:7]1[cH:8][cH:9][c:10]([C:11]#[N:12])[cH:13][cH:14]1

Participants

4

Reactant 3

HCID 6342AcetonitrileHCID 222353954-[2-(Oxiran-2-yl)ethoxy]benzonitrileHCID 22490264Tert-butyl 3,7-diazabicyclo(3.3.1)nonane-3-carboxylate

Product 1

HCID 54019853HCID 54019853, compound

Sources & evidence

ORD record
ord-722105b6d0b74771acd3902557e0e2dd
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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