1,2-Diethylbenzene → HCID 178475244, 화합물

HRID 187927

반응식

HRID 187927 반응식
[C:1]([CH3:2])(=[O:3])[O:4][CH:5]1[C:6]2([F:39])[C:7]3([CH3:38])[CH:8]=[CH:9][C:10](=[O:37])[CH:11]=[C:12]3[CH2:13][CH2:14][CH:15]2[CH:16]2[CH2:17][CH2:18][C:19]([S:23][c:24]3[cH:25][cH:26][cH:27][cH:28][cH:29]3)([S:30][c:31]3[cH:32][cH:33][cH:34][cH:35][cH:36]3)[C:20]2([CH3:21])[CH2:22]1.[CH2:40]([c:41]1[cH:42][cH:43][cH:44][cH:45][c:46]1[CH2:47][CH3:48])[CH3:49]>>[C:1]([CH3:2])(=[O:3])[O:4][CH:5]1[C:6]2([F:39])[C:7]3([CH3:38])[CH:8]=[CH:9][C:10](=[O:37])[CH:11]=[C:12]3[CH2:13][CH2:14][CH:15]2[CH:16]2[CH2:17][CH:18]=[C:19]([S:23][c:24]3[cH:25][cH:26][cH:27][cH:28][cH:29]3)[C:20]2([CH3:21])[CH2:22]1

참가 물질

3

반응물 2

HCID 86571,2-DiethylbenzeneHCID 178475221HCID 178475221, 화합물

생성물 1

HCID 178475244HCID 178475244, 화합물

출처 및 근거

ORD 기록
ord-47e5b75498864a45bcbb03e02b098e2f
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

연결된 노트

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