Hydrochloric Acid → HCID 22218215, 화합물
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[Br:6][c:7]1[cH:8][c:9]2[c:14]([cH:15][c:16]1[O:17][CH3:18])[C:13]([CH3:19])([CH3:20])[CH2:12][CH:11]=[C:10]2[CH:21]([CH3:22])[CH3:23].[CH2:3]([SH:4])[CH3:5].[ClH:24].[H-:1].[Na+:2].[O:25]=[CH:26][N:27]([CH3:28])[CH3:29].[OH2:30]>>[Br:6][c:7]1[cH:8][c:9]2[c:14]([cH:15][c:16]1[OH:17])[C:13]([CH3:19])([CH3:20])[CH2:12][CH:11]=[C:10]2[CH:21]([CH3:22])[CH3:23]참가 물질
8
출처 및 근거
- ORD 기록
- ord-ec7f71d989224516930e7e5de3f1fe20
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
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