Ethanol → HCID 67045940, compound

HRID 1240163Notes

Reaction equation

HRID 1240163 reaction equation
[CH3:1][O:2][C:3](=[O:4])[CH:5]1[N:6]([c:36]2[n:37][cH:38][c:39]([C:42]([F:43])([F:44])[F:45])[cH:40][cH:41]2)[CH2:7][CH2:8][N:9]([S:11](=[O:12])(=[O:13])[c:14]2[cH:15][c:16]3[c:20]([cH:21][cH:22]2)[CH2:19][CH2:18][CH:17]3[C:23](=[O:24])[O:25][CH2:26][c:27]2[cH:28][cH:29][c:30]([N+:31]([O-:32])=[O:33])[cH:34][cH:35]2)[CH2:10]1.[CH3:52][CH2:53][OH:54].[CH:46]1=[CH:51][CH:50]=[CH:49][CH2:48][CH2:47]1>>[CH3:1][O:2][C:3](=[O:4])[CH:5]1[N:6]([c:36]2[n:37][cH:38][c:39]([C:42]([F:43])([F:44])[F:45])[cH:40][cH:41]2)[CH2:7][CH2:8][N:9]([S:11](=[O:12])(=[O:13])[c:14]2[cH:15][c:16]3[c:20]([cH:21][cH:22]2)[CH2:19][CH2:18][CH:17]3[C:23](=[O:24])[OH:25])[CH2:10]1

Participants

4

Reactant 3

HCID 702EthanolHCID 116051,3-CyclohexadieneHCID 67046029HCID 67046029, compound

Product 1

HCID 67045940HCID 67045940, compound

Sources & evidence

ORD record
ord-a6bff829a16e40fbab6065c2a7f0b3bf
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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