Acetonitrile → HCID 69742721, compound

HRID 696875Notes

Reaction equation

HRID 696875 reaction equation
[C:31]([CH3:32])([CH3:33])([CH3:34])[O:35][C:36](=[O:37])[NH-:38].[CH2:1]([CH3:2])[O:3][C:4](=[O:5])[C:6]1([C:26](=[O:27])[O:28][CH2:29][CH3:30])[N:7]([c:11]2[cH:12][n:13][c:14]([O:17][c:18]3[cH:19][cH:20][c:21]([CH:24]=[O:25])[cH:22][cH:23]3)[cH:15][cH:16]2)[CH2:8][CH2:9][CH2:10]1.[CH2:39]([SiH:40]([CH2:41][CH3:42])[CH2:43][CH3:44])[CH3:45].[CH3:53][CH2:54][O:55][C:56](=[O:57])[CH3:58].[CH3:59][C:60]#[N:61].[OH:46][C:47]([C:48]([F:49])([F:50])[F:51])=[O:52]>>[CH2:1]([CH3:2])[O:3][C:4](=[O:5])[C:6]1([C:26](=[O:27])[O:28][CH2:29][CH3:30])[N:7]([c:11]2[cH:12][n:13][c:14]([O:17][c:18]3[cH:19][cH:20][c:21]([CH2:24][NH:38][C:36]([O:35][C:31]([CH3:32])([CH3:33])[CH3:34])=[O:37])[cH:22][cH:23]3)[cH:15][cH:16]2)[CH2:8][CH2:9][CH2:10]1

Participants

7

Reactant 6

HCID 6342AcetonitrileHCID 6422Trifluoroacetic acidHCID 8857Ethyl AcetateHCID 12052TriethylsilaneHCID 86588174HCID 86588174, compoundHCID 178450610HCID 178450610, compound

Product 1

HCID 69742721HCID 69742721, compound

Sources & evidence

ORD record
ord-05c1b43f19794d7bbcb466c16ffc2943
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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