2,2-Dimethyl-3,4-epoxy-6-cyanochroman → HCID 178431193, 화합물

반응식

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

참가 물질

반응물 2

HCID 108673602,2-Dimethyl-3,4-epoxy-6-cyanochroman

HCID 112405975-Fluorobenzo[d]isoxazol-3(2H)-one

생성물 1

HCID 178431193HCID 178431193, 화합물

출처 및 근거

ORD 기록: ord-2b73456bf4bf4c4aa925ed6fad0abdd5
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (3/10)
DOI: 10.1039/C8SC04228D

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