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Bicarbonate Ion → N,6,6-trimethyl-N-[[3-(3-methylbut-1-en-2-yl)phenyl]methyl]hept-2-en-4-yn-1-amine

HRID 184496
노트
인쇄 미리보기

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HRID 184496 반응식
[C:30](=[O:31])([OH:32])[O-:33].[CH3:1][C:2]([C:3]#[C:4][CH:5]=[CH:6][CH2:7][N:8]([CH3:9])[CH2:10][c:11]1[cH:12][c:13]([C:17]([CH3:18])([CH:19]([CH3:20])[CH3:21])[OH:22])[cH:14][cH:15][cH:16]1)([CH3:23])[CH3:24].[Na+:34].[P:25]([Cl:26])([Cl:27])([Cl:28])=[O:29].[cH:35]1[cH:36][cH:37][n:38][cH:39][cH:40]1>>[CH3:1][C:2]([C:3]#[C:4][CH:5]=[CH:6][CH2:7][N:8]([CH3:9])[CH2:10][c:11]1[cH:12][c:13]([C:17](=[CH2:18])[CH:19]([CH3:20])[CH3:21])[cH:14][cH:15][cH:16]1)([CH3:23])[CH3:24]
참가 물질출처 및 근거반응 노트

참가 물질

6

반응물 5

HCID 769Bicarbonate IonHCID 923Sodium IonHCID 1049PyridineHCID 24813Phosphorus oxychlorideHCID 910995222-[3-[[6,6-Dimethylhept-2-en-4-ynyl(methyl)amino]methyl]phenyl]-3-methylbutan-2-ol

생성물 1

HCID 73447785N,6,6-trimethyl-N-[[3-(3-methylbut-1-en-2-yl)phenyl]methyl]hept-2-en-4-yn-1-amine

출처 및 근거

ORD 기록
ord-7477698572124673bcf516602623049a
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (6/10)
DOI
10.1039/C8SC04228D

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