Toluene → HCID 12588371, 화합물

HRID 184237

반응식

[C:12]([CH:13]=[CH:14][C:15](=[O:16])[O:17][CH2:18][CH3:19])(=[O:20])[O:21][CH2:22][CH3:23].[CH2:1]1[c:6]2[c:5]([cH:10][cH:9][cH:8][cH:7]2)[CH2:4][S:2](=[O:3])[O:11]1.[CH3:24][c:25]1[cH:26][cH:27][cH:28][cH:29][cH:30]1>>[CH2:1]1[c:6]2[c:5]([cH:10][cH:9][cH:8][cH:7]2)[CH2:4][CH:13]([C:12](=[O:20])[O:21][CH2:22][CH3:23])[CH:14]1[C:15](=[O:16])[O:17][CH2:18][CH3:19]

참가 물질

반응물 3

HCID 1140Toluene

HCID 12201Diethyl 2-butenedioate

HCID 118298361,4-dihydro-2,3-benzoxathiin-3-oxide

생성물 1

HCID 12588371HCID 12588371, 화합물

출처 및 근거

ORD 기록: ord-0997464bc7ff44c8a5ef1c2529f0e305
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (6/10)
DOI: 10.1039/C8SC04228D

연결된 노트

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