Sodium ion → 2,2-Diphenylpent-4-ynenitrile

HRID 114403

반응식

HRID 114403 반응식
[CH2:16]([C:17]#[CH:18])[Cl:19].[CH2:27]([N+:28]([CH2:29][CH2:30][CH2:31][CH3:32])([CH2:33][CH2:34][CH2:35][CH3:36])[CH2:37][CH2:38][CH2:39][CH3:40])[CH2:41][CH2:42][CH3:43].[Na+:21].[OH-:20].[OH2:44].[S:22]([O-:23])([OH:24])(=[O:25])=[O:26].[c:1]1([CH:7]([C:8]#[N:9])[c:10]2[cH:11][cH:12][cH:13][cH:14][cH:15]2)[cH:2][cH:3][cH:4][cH:5][cH:6]1>>[c:1]1([C:7]([C:8]#[N:9])([c:10]2[cH:11][cH:12][cH:13][cH:14][cH:15]2)[CH2:18][C:17]#[CH:16])[cH:2][cH:3][cH:4][cH:5][cH:6]1

참가 물질

8

출처 및 근거

ORD 기록
ord-74b20fedfac24238a53d468a8c952be4
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

연결된 노트

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