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Acetic Acid → 9-(8-azabicyclo[3.2.1]octan-3-ylidene)-N,N-diethylxanthene-3-carboxamide

HRID 153192
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인쇄 미리보기

반응식

HRID 153192 반응식
[BrH:35].[CH2:1]([O:2][C:3](=[O:4])[N:6]1[CH:7]2[CH2:8][C:9](=[C:14]3[c:15]4[cH:16][cH:17][cH:18][cH:19][c:20]4[O:21][c:22]4[cH:23][c:24]([C:28]([N:29]([CH2:30][CH3:31])[CH2:32][CH3:33])=[O:34])[cH:25][cH:26][c:27]43)[CH2:10][CH:11]1[CH2:12][CH2:13]2)[CH3:5].[CH3:38][C:39](=[O:40])[OH:41].[Na+:37].[OH-:36]>>[NH:6]1[CH:7]2[CH2:8][C:9](=[C:14]3[c:15]4[cH:16][cH:17][cH:18][cH:19][c:20]4[O:21][c:22]4[cH:23][c:24]([C:28]([N:29]([CH2:30][CH3:31])[CH2:32][CH3:33])=[O:34])[cH:25][cH:26][c:27]43)[CH2:10][CH:11]1[CH2:12][CH2:13]2
참가 물질출처 및 근거반응 노트

참가 물질

6

반응물 5

HCID 176Acetic AcidHCID 260Hydrogen BromideHCID 923Sodium IonHCID 961HydroxideHCID 578392423-(3-Diethylcarbamoyl-xanthen-9-ylidene)-8-aza-bicyclo[3.2.1]octane-8-carboxylic acid ethyl ester

생성물 1

HCID 469181419-(8-azabicyclo[3.2.1]octan-3-ylidene)-N,N-diethylxanthene-3-carboxamide
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출처 및 근거

ORD 기록
ord-6496d6eefd804c9380ed55ee6b9066b5
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI
10.1039/C8SC04228D

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