1-Bromo-4-tert-butylbenzene → 10-(4-tert-Butyl-phenyl)-1,4-dioxa-10-aza-dispiro[4.2.4.2]tetradecan-9-one

반응식

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

참가 물질

반응물 2

HCID 775951-Bromo-4-tert-butylbenzene

HCID 582301081,4-Dioxa-10-azadispiro[4.2.4.2]tetradecan-9-one

생성물 1

HCID 6657950810-(4-tert-Butyl-phenyl)-1,4-dioxa-10-aza-dispiro[4.2.4.2]tetradecan-9-one

출처 및 근거

ORD 기록: ord-bb05edd72d704279aff22b6f559d3ebd
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (3/10)
DOI: 10.1039/C8SC04228D

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