Hexane → HCID 23114028, compound

HRID 697907Notes

Reaction equation

HRID 697907 reaction equation
[C:38]([O:39][CH2:40][CH3:41])(=[O:42])[CH3:43].[CH3:32][CH2:33][CH2:34][CH2:35][CH2:36][CH3:37].[OH:1][C:2]1([c:24]2[cH:25][cH:26][c:27]([O:30][CH3:31])[cH:28][cH:29]2)[C:3]([CH3:22])([CH3:23])[O:4][c:5]2[c:6]1[c:7]([CH3:21])[c:8]([NH:13][C:14]([CH2:15][C:16]([CH3:17])([CH3:18])[CH3:19])=[O:20])[c:9]([CH3:12])[c:10]2[CH3:11]>>[CH:2]1([c:24]2[cH:25][cH:26][c:27]([O:30][CH3:31])[cH:28][cH:29]2)[C:3]([CH3:22])([CH3:23])[O:4][c:5]2[c:6]1[c:7]([CH3:21])[c:8]([NH:13][C:14]([CH2:15][C:16]([CH3:17])([CH3:18])[CH3:19])=[O:20])[c:9]([CH3:12])[c:10]2[CH3:11]

Participants

4

Reactant 3

HCID 8058HexaneHCID 8857Ethyl AcetateHCID 23113827HCID 23113827, compound

Product 1

HCID 23114028HCID 23114028, compound

Sources & evidence

ORD record
ord-4a52858c16de4a0994c629ed230c0db1
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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