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Calcium Cation → 2-Chloro-5-methylsulphinyl-N-(tricyclo[3.3.1.13,7]dec-1-ylmethyl)-benzamide

HRID 93240
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HRID 93240 반응식
[CH:38]([Cl:39])([Cl:40])[Cl:41].[Ca+2:36].[Cl:1][c:2]1[c:3]([C:4](=[O:5])[NH:6][CH2:7][C:8]23[CH2:9][CH:10]4[CH2:11][CH:12]([CH2:13][CH:14]([CH2:15]2)[CH2:16]4)[CH2:17]3)[cH:18][c:19]([S:22][CH3:23])[cH:20][cH:21]1.[Cl:24][c:25]1[c:26]([C:27]([O:28][OH:29])=[O:32])[cH:30][cH:31][cH:33][cH:34]1.[OH-:35].[OH-:37]>>[Cl:1][c:2]1[c:3]([C:4](=[O:5])[NH:6][CH2:7][C:8]23[CH2:9][CH:10]4[CH2:11][CH:12]([CH2:13][CH:14]([CH2:15]2)[CH2:16]4)[CH2:17]3)[cH:18][c:19]([S:22]([CH3:23])=[O:32])[cH:20][cH:21]1
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반응물 5

HCID 271Calcium CationHCID 961Hydroxide2회HCID 6212ChloroformHCID 89239442-Chloro-5-methylthio-N-(tricyclo[3.3.1.13,7]dec-1-ylmethyl)-benzamideHCID 125873982-Chlorobenzene-1-carboperoxoic acid

생성물 1

HCID 183815322-Chloro-5-methylsulphinyl-N-(tricyclo[3.3.1.13,7]dec-1-ylmethyl)-benzamide

출처 및 근거

ORD 기록
ord-6e8b5d5514c64305a7d7782025e4adae
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI
10.1039/C8SC04228D

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