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Potassium Cation → 1-(1,3-Benzothiazol-6-yl)cyclopropanecarbaldehyde

HRID 115354
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HRID 115354 반응식
[C:29]([CH:30]([CH:31]([C:32]([O-:33])=[O:34])[OH:35])[OH:36])([O-:37])=[O:38].[CH2:2]([Al+:3][CH2:4][CH:5]([CH3:6])[CH3:7])[CH:8]([CH3:9])[CH3:10].[CH3:41][c:42]1[cH:43][cH:44][cH:45][cH:46][cH:47]1.[CH:25]([CH3:26])([CH3:27])[OH:28].[H-:1].[K+:40].[Na+:39].[s:11]1[cH:12][n:13][c:14]2[c:15]1[cH:16][c:17]([C:20]1([C:23]#[N:24])[CH2:21][CH2:22]1)[cH:18][cH:19]2>>[s:11]1[cH:12][n:13][c:14]2[c:15]1[cH:16][c:17]([C:20]1([CH:23]=[O:28])[CH2:21][CH2:22]1)[cH:18][cH:19]2
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HCID 813Potassium CationHCID 923Sodium IonHCID 1140TolueneHCID 3776IsopropanolHCID 166653HydrideHCID 38061142,3-DihydroxybutanedioateHCID 16686348Bis(2-methylpropyl)alumanyliumHCID 592163041-(1,3-Benzothiazol-6-yl)cyclopropanecarbonitrile

생성물

출처 및 근거

ORD 기록
ord-5bc958013e1f4fc78e89929d1fb91550
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI
10.1039/C8SC04228D

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HCID 823968391-(1,3-Benzothiazol-6-yl)cyclopropanecarbaldehyde