Acetonitrile → HCID 57884167, compound

HRID 321701Notes

Reaction equation

HRID 321701 reaction equation
[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[c:8]1[cH:9][cH:10][c:11]([C:12](=[O:13])[OH:14])[cH:15][cH:16]1.[CH3:17][O:18][c:19]1[cH:20][c:21]([C:27]2([CH2:32][NH2:33])[CH2:28][CH2:29][CH2:30][CH2:31]2)[cH:22][cH:23][c:24]1[O:25][CH3:26].[CH3:34][CH2:35][N:36]([CH2:37][CH3:38])[CH2:39][CH3:40].[CH3:65][C:66]#[N:67].[P-:41]([F:42])([F:43])([F:44])([F:45])([F:46])[F:47].[n:48]1([O:49][C:50]([N:51]([CH3:52])[CH3:53])=[N+:54]([CH3:55])[CH3:56])[c:57]2[n:58][cH:59][cH:60][cH:61][c:62]2[n:63][n:64]1>>[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[c:8]1[cH:9][cH:10][c:11]([C:12](=[O:14])[NH:33][CH2:32][C:27]2([c:21]3[cH:20][c:19]([O:18][CH3:17])[c:24]([O:25][CH3:26])[cH:23][cH:22]3)[CH2:28][CH2:29][CH2:30][CH2:31]2)[cH:15][cH:16]1

Participants

7

Reactant 6

HCID 6342AcetonitrileHCID 8471TriethylamineHCID 9886HexafluorophosphateHCID 1364294-Benzylbenzoic acidHCID 739193STK362959HCID 4641409(Dimethylamino)-N,N-dimethyl(3H-(1,2,3)triazolo(4,5-b)pyridin-3-yloxy)methaniminium

Product 1

HCID 57884167HCID 57884167, compound

Sources & evidence

ORD record
ord-a825a4cc99cc4b13868dad7793f7a1d0
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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