Acetone → HCID 178422635, 화합물

반응식

[CH3:1][C:2]1=[CH:19][CH2:18][C:17]2([CH3:20])[CH:4]([CH2:3]1)[CH2:5][CH2:6][CH:7]1[CH:8]3[CH2:9][CH2:10][CH:11]([OH:21])[C:12]3([CH3:13])[CH2:14][CH2:15][CH:16]12.[CH3:23][C:24](=[O:25])[CH3:26].[OH2:22]>>[CH3:1][C:2]1=[CH:19][CH2:18][C:17]2([CH3:20])[CH:4]([CH2:3]1)[CH2:5][CH2:6][CH:7]1[CH:8]3[CH2:9][CH2:10][C:11](=[O:21])[C:12]3([CH3:13])[CH2:14][CH2:15][CH:16]12

참가 물질

반응물 3

HCID 180Acetone

HCID 962Water

HCID 4400645HCID 4400645, 화합물

생성물 1

HCID 178422635HCID 178422635, 화합물

출처 및 근거

ORD 기록: ord-0392e6e66d164b2680f0d3cdf41896f4
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (5/10)
DOI: 10.1039/C8SC04228D

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