Bicarbonate Ion → 1-(Isocyanatomethyl)-4-methylbenzene
반응식
[C:10]([O-:11])(=[O:12])[OH:13].[CH3:1][c:2]1[cH:3][cH:4][c:5]([CH2:6][NH2:7])[cH:8][cH:9]1.[CH3:22][c:23]1[cH:24][cH:25][cH:26][cH:27][cH:28]1.[Cl:15][C:16](=[O:17])[Cl:18].[Cl:19][CH2:20][Cl:21].[Na+:14]>>[CH3:1][c:2]1[cH:3][cH:4][c:5]([CH2:6][N:7]=[C:10]=[O:11])[cH:8][cH:9]1참가 물질
7
출처 및 근거
- ORD 기록
- ord-9b6a7390ba2e4128bc20ac2dd44d42c8
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
반응 노트
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