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Tetrahydrofuran → [6-(2-Bromoacetyl)-8-(tert-butyl)-3,4-dihydro-2H-1,4-benzoxazin-4-yl]methyl cyanide

HRID 690262
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반응식

HRID 690262 반응식
[Br:28][N:29]1[C:30](=[O:31])[CH2:32][CH2:33][C:34]1=[O:35].[C:8]([CH3:9])(=[O:10])[c:11]1[cH:12][c:13]([C:24]([CH3:25])([CH3:26])[CH3:27])[c:14]2[c:15]([cH:23]1)[N:16]([CH2:20][C:21]#[N:22])[CH2:17][CH2:18][O:19]2.[CH3:1][CH2:2][N:3]([CH2:4][CH3:5])[CH2:6][CH3:7].[CH3:36][CH2:37][O:38][C:39](=[O:40])[CH3:41].[O:42]1[CH2:43][CH2:44][CH2:45][CH2:46]1>>[C:8]([CH2:9][Br:28])(=[O:10])[c:11]1[cH:12][c:13]([C:24]([CH3:25])([CH3:26])[CH3:27])[c:14]2[c:15]([cH:23]1)[N:16]([CH2:20][C:21]#[N:22])[CH2:17][CH2:18][O:19]2
참가 물질출처 및 근거반응 노트

참가 물질

6

반응물 5

HCID 8028TetrahydrofuranHCID 8471TriethylamineHCID 8857Ethyl AcetateHCID 67184N-bromobutanimideHCID 22930164(6-acetyl-8-(tert-butyl)-3,4-dihydro-2H-1,4-benzoxazin-4-yl]methyl cyanide

생성물 1

HCID 58910016[6-(2-Bromoacetyl)-8-(tert-butyl)-3,4-dihydro-2H-1,4-benzoxazin-4-yl]methyl cyanide
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출처 및 근거

ORD 기록
ord-105ef15198a64e5f8d8209dc1a63b533
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (3/10)
DOI
10.1039/C8SC04228D

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