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Potassium Cation → 4-[(4-Iodophenyl)(3,3,5,5-tetramethylcyclohexylidene)methyl]phenol

HRID 671406
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HRID 671406 반응식
[CH2:34]1[O:35][CH2:36][CH2:37][CH2:38]1.[CH3:17][C:18]1([CH3:27])[CH2:19][C:20](=[O:26])[CH2:21][C:22]([CH3:24])([CH3:25])[CH2:23]1.[K+:28].[K+:29].[O-:30][C:31]([O-:32])=[O:33].[OH:1][c:2]1[cH:3][cH:4][c:5]([C:8](=[O:9])[c:10]2[cH:11][cH:12][c:13]([I:16])[cH:14][cH:15]2)[cH:6][cH:7]1.[Zn:39]>>[OH:1][c:2]1[cH:3][cH:4][c:5]([C:8]([c:10]2[cH:11][cH:12][c:13]([I:16])[cH:14][cH:15]2)=[C:20]2[CH2:19][C:18]([CH3:17])([CH3:27])[CH2:23][C:22]([CH3:24])([CH3:25])[CH2:21]2)[cH:6][cH:7]1
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HCID 813Potassium Cation2회HCID 8028TetrahydrofuranHCID 19660Carbonate IonHCID 23994ZincHCID 843993,3,5,5-TetramethylcyclohexanoneHCID 13453359(4-Hydroxyphenyl)(4-iodophenyl)methanone

생성물 1

HCID 686545464-[(4-Iodophenyl)(3,3,5,5-tetramethylcyclohexylidene)methyl]phenol

출처 및 근거

ORD 기록
ord-e1ef9f28702a4a0697a433e99254d91c
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (3/10)
DOI
10.1039/C8SC04228D

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