Hexane → HCID 70112330, compound

HRID 158170Notes

Reaction equation

HRID 158170 reaction equation
[C:33]([O:34][CH2:35][CH3:36])(=[O:37])[CH3:38].[CH3:27][CH2:28][CH2:29][CH2:30][CH2:31][CH3:32].[cH:1]1[c:2]([CH2:11][N:12]2[c:13]3[c:14]([cH:23][cH:24][cH:25][cH:26]3)[N:15]=[C:16]3[CH:17]([C:18]2=[O:19])[CH2:20][CH2:21][CH2:22]3)[cH:3][cH:4][c:5]2[cH:6][cH:7][cH:8][cH:9][c:10]12>>[cH:1]1[c:2]([CH2:11][N:12]2[c:13]3[c:14]([cH:23][cH:24][cH:25][cH:26]3)[NH:15][CH:16]3[CH:17]([C:18]2=[O:19])[CH2:20][CH2:21][CH2:22]3)[cH:3][cH:4][c:5]2[cH:6][cH:7][cH:8][cH:9][c:10]12

Participants

4

Reactant 3

HCID 8058HexaneHCID 8857Ethyl AcetateHCID 18940579HCID 18940579, compound

Product 1

HCID 70112330HCID 70112330, compound

Sources & evidence

ORD record
ord-ff7a7fd76ecf4c8890d06481e0af3dd3
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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