Acetonitrile → HCID 21876726, compound

HRID 2145764Notes

Reaction equation

HRID 2145764 reaction equation
[CH3:31][C:32]#[N:33].[CH:12]([N:13]([CH2:14][CH3:15])[CH:16]([CH3:17])[CH3:18])([CH3:19])[CH3:20].[F:1][c:2]1[cH:3][c:4]([N+:9](=[O:10])[O-:11])[cH:5][cH:6][c:7]1[F:8].[O:21]1[CH2:22][CH2:23][O:24][C:25]12[CH2:26][CH2:27][NH:28][CH2:29][CH2:30]2>>[F:1][c:2]1[cH:3][c:4]([N+:9](=[O:10])[O-:11])[cH:5][cH:6][c:7]1[N:28]1[CH2:27][CH2:26][C:25]2([O:21][CH2:22][CH2:23][O:24]2)[CH2:30][CH2:29]1

Participants

5

Reactant 4

HCID 6342AcetonitrileHCID 674351,4-Dioxa-8-azaspiro(4.5)decaneHCID 81531DiisopropylethylamineHCID 1230531,2-Difluoro-4-nitrobenzene

Product 1

HCID 21876726HCID 21876726, compound

Sources & evidence

ORD record
ord-6a68ddff976b4d028384f36f299281ed
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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