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Acetone → 9a-butyl-7-methoxy-4-{4-[2-(1-piperidinyl)ethoxy]phenyl}-1,2,9,9a-tetrahydro-3H-fluoren-3-one

HRID 1231522
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HRID 1231522 반응식
[C:28](=[O:29])([O-:30])[O-:31].[CH2:1]([CH2:2][CH2:3][CH3:4])[C:5]12[CH2:6][c:7]3[cH:8][c:9]([O:26][CH3:27])[cH:10][cH:11][c:12]3[C:13]1=[C:14]([c:19]1[cH:20][cH:21][c:22]([OH:25])[cH:23][cH:24]1)[C:15](=[O:18])[CH2:16][CH2:17]2.[CH3:44][C:45](=[O:46])[CH3:47].[CH3:48][CH2:49][O:50][C:51]([CH3:52])=[O:53].[Cl:35][CH2:36][CH2:37][N:38]1[CH2:39][CH2:40][CH2:41][CH2:42][CH2:43]1.[ClH:34].[Cs+:32].[Cs+:33]>>[CH2:1]([CH2:2][CH2:3][CH3:4])[C:5]12[CH2:6][c:7]3[cH:8][c:9]([O:26][CH3:27])[cH:10][cH:11][c:12]3[C:13]1=[C:14]([c:19]1[cH:20][cH:21][c:22]([O:25][CH2:36][CH2:37][N:38]3[CH2:39][CH2:40][CH2:41][CH2:42][CH2:43]3)[cH:23][cH:24]1)[C:15](=[O:18])[CH2:16][CH2:17]2
참가 물질출처 및 근거반응 노트

참가 물질

8

반응물 7

HCID 180AcetoneHCID 313Hydrochloric AcidHCID 8857Ethyl AcetateHCID 19660Carbonate IonHCID 748271-(2-Chloroethyl)piperidineHCID 104967Cesium cation2회HCID 219909159a-butyl-4-(4-hydroxyphenyl)-7-methoxy-1,2,9,9a-tetrahydro-3H-fluoren-3-one

생성물 1

HCID 219909249a-butyl-7-methoxy-4-{4-[2-(1-piperidinyl)ethoxy]phenyl}-1,2,9,9a-tetrahydro-3H-fluoren-3-one

출처 및 근거

ORD 기록
ord-c980acc2da5d4720a41662db45d93390
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (5/10)
DOI
10.1039/C8SC04228D

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