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Sodium Ion → [4-(Diphenylmethoxy)-3-isobutylphenyl]methanol

HRID 685333
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HRID 685333 반응식
[Al+3:30].[H-:29].[H-:32].[H-:33].[H-:34].[Li+:31].[Na+:50].[Na+:51].[O:52]1[CH2:53][CH2:54][CH2:55][CH2:56]1.[OH2:35].[OH2:36].[OH2:37].[OH2:38].[OH2:39].[OH2:40].[OH2:41].[OH2:42].[OH2:43].[OH2:44].[S:45]([O-:46])([O-:47])(=[O:48])=[O:49].[c:1]1([CH:7]([O:8][c:9]2[c:10]([CH2:19][CH:20]([CH3:21])[CH3:22])[cH:11][c:12]([C:13](=[O:14])[O:15][CH3:16])[cH:17][cH:18]2)[c:23]2[cH:24][cH:25][cH:26][cH:27][cH:28]2)[cH:2][cH:3][cH:4][cH:5][cH:6]1>>[c:1]1([CH:7]([O:8][c:9]2[c:10]([CH2:19][CH:20]([CH3:21])[CH3:22])[cH:11][c:12]([CH2:13][OH:14])[cH:17][cH:18]2)[c:23]2[cH:24][cH:25][cH:26][cH:27][cH:28]2)[cH:2][cH:3][cH:4][cH:5][cH:6]1
참가 물질출처 및 근거반응 노트

참가 물질

9

반응물 8

HCID 923Sodium Ion2회HCID 962Water10회HCID 1117Sulfate IonHCID 8028TetrahydrofuranHCID 28486Lithium ionHCID 104727Aluminum CationHCID 166653Hydride4회
HCID 23157404
Methyl 4-(diphenylmethoxy)-3-isobutylbenzoate

생성물 1

HCID 23157345[4-(Diphenylmethoxy)-3-isobutylphenyl]methanol

출처 및 근거

ORD 기록
ord-620ba5c5234947d7a212465f6ac8b334
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (3/10)
DOI
10.1039/C8SC04228D

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