Methanol → HCID 57743040, 화합물
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[Br:1][c:2]1[cH:3][n:4][n:5]([CH3:23])[c:6]1[CH2:7][N:8]1[C:9](=[O:22])[CH2:10][CH:11]([c:13]2[c:14]([F:21])[c:15]([F:20])[cH:16][c:17]([F:19])[cH:18]2)[CH2:12]1.[CH3:24][OH:25]>>[cH:2]1[cH:3][n:4][n:5]([CH3:23])[c:6]1[CH2:7][N:8]1[C:9](=[O:22])[CH2:10][CH:11]([c:13]2[c:14]([F:21])[c:15]([F:20])[cH:16][c:17]([F:19])[cH:18]2)[CH2:12]1참가 물질
3
출처 및 근거
- ORD 기록
- ord-53ffb0bce9df483398cf417a6f60db3d
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
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