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Acetone → HCID 15712403, 화합물

HRID 1231664
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HRID 1231664 반응식
[Br:23][CH2:24][CH2:25][CH2:26][S:27][c:28]1[c:29]([CH2:38][CH2:39][CH3:40])[c:30]([OH:37])[c:31]([C:34]([CH3:35])=[O:36])[cH:32][cH:33]1.[C:1]([CH3:2])(=[O:3])[c:4]1[cH:5][cH:6][c:7]([SH:22])[c:8]([CH2:19][CH2:20][CH3:21])[c:9]1[O:10][CH2:11][CH2:12][CH2:13][C:14](=[O:15])[O:16][CH2:17][CH3:18].[C:43](=[O:44])([O-:45])[O-:46].[CH3:49][C:50](=[O:51])[CH3:52].[I-:42].[K+:41].[K+:47].[K+:48]>>[C:1]([CH3:2])(=[O:3])[c:4]1[cH:5][cH:6][c:7]([S:22][CH2:24][CH2:25][CH2:26][S:27][c:28]2[c:29]([CH2:38][CH2:39][CH3:40])[c:30]([OH:37])[c:31]([C:34]([CH3:35])=[O:36])[cH:32][cH:33]2)[c:8]([CH2:19][CH2:20][CH3:21])[c:9]1[O:10][CH2:11][CH2:12][CH2:13][C:14](=[O:15])[O:16][CH2:17][CH3:18]
참가 물질출처 및 근거반응 노트

참가 물질

7

반응물 6

HCID 180AcetoneHCID 813Potassium Cation3회HCID 19660Carbonate IonHCID 30165Iodide IonHCID 157123831-{4-[(3-Bromopropyl)sulfanyl]-2-hydroxy-3-propylphenyl}ethan-1-oneHCID 15712395HCID 15712395, 화합물

생성물 1

HCID 15712403
HCID 15712403, 화합물

출처 및 근거

ORD 기록
ord-4196ecc716554b56b87618177de74609
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (5/10)
DOI
10.1039/C8SC04228D

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