Acetonitrile → HCID 67642579, compound

HRID 2130115Notes

Reaction equation

HRID 2130115 reaction equation
[CH2:1]([CH3:2])[O:3][C:4]([CH2:5][C:6]([CH:7]([CH:8]([CH2:9][c:10]1[cH:11][cH:12][cH:13][cH:14][cH:15]1)[NH:16][C:17](=[O:18])[O:19][CH2:20][c:21]1[cH:22][cH:23][cH:24][cH:25][cH:26]1)[OH:27])=[O:28])=[O:29].[CH3:37][C:38]#[N:39].[OH:30][C:31]([C:32]([F:33])([F:34])[F:35])=[O:36]>>[CH2:1]([CH3:2])[O:3][C:4]([CH2:5][C:6]([C:7]([CH:8]([CH2:9][c:10]1[cH:11][cH:12][cH:13][cH:14][cH:15]1)[NH:16][C:17](=[O:18])[O:19][CH2:20][c:21]1[cH:22][cH:23][cH:24][cH:25][cH:26]1)=[O:27])=[O:28])=[O:29]

Participants

4

Reactant 3

HCID 6342AcetonitrileHCID 6422Trifluoroacetic acidHCID 67641967HCID 67641967, compound

Product 1

HCID 67642579HCID 67642579, compound

Sources & evidence

ORD record
ord-cdd1c41012bd4826b10e5b831ad70ecd
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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