Ethanol → Methyl 4-tert-butyl-3-isopropylbenzoate
반응식
[C:1]([CH3:2])([CH3:3])([CH3:4])[c:5]1[c:6]([C:15](=[CH2:16])[CH3:17])[cH:7][c:8]([C:9](=[O:10])[O:11][CH3:12])[cH:13][cH:14]1.[CH3:20][CH2:21][OH:22].[CH3:23][CH2:24][O:25][C:26]([CH3:27])=[O:28].[H:18][H:19]>>[C:1]([CH3:2])([CH3:3])([CH3:4])[c:5]1[c:6]([CH:15]([CH3:16])[CH3:17])[cH:7][c:8]([C:9](=[O:10])[O:11][CH3:12])[cH:13][cH:14]1참가 물질
5
출처 및 근거
- ORD 기록
- ord-c276d078241e45a099e0241916c317c5
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
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