Water → HCID 69203598, compound

HRID 674127Notes

Reaction equation

HRID 674127 reaction equation
[CH2:1]([O:2][P:3](=[O:4])([O:5][CH2:6][CH3:7])[CH2:9][C:10]#[N:11])[CH3:8].[CH2:42]1[O:43][CH2:44][CH2:45][CH2:46]1.[CH3:12][Si:13]([N-:14][Si:15]([CH3:16])([CH3:17])[CH3:18])([CH3:19])[CH3:20].[Li+:21].[O:22]1[CH2:23][O:24][c:25]2[c:26]1[cH:27][cH:28][c:29]([C:31](=[O:32])[c:33]1[cH:34][cH:35][c:36]([O:39][CH3:40])[cH:37][cH:38]1)[cH:30]2.[OH2:41]>>[CH:9]([C:10]#[N:11])=[C:31]([c:29]1[cH:28][cH:27][c:26]2[c:25]([cH:30]1)[O:24][CH2:23][O:22]2)[c:33]1[cH:34][cH:35][c:36]([O:39][CH3:40])[cH:37][cH:38]1

Participants

7

Reactant 6

HCID 962WaterHCID 8028TetrahydrofuranHCID 28486Lithium ionHCID 75676Diethyl (cyanomethyl)phosphonateHCID 3280088Npc316347HCID 24820230HCID 24820230, compound

Product 1

HCID 69203598HCID 69203598, compound

Sources & evidence

ORD record
ord-c9a30055a3234489ab3a9532a82e74ce
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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