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Bicarbonate Ion → HCID 68485337, 화합물

HRID 946477
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HRID 946477 반응식
[C:64](=[O:65])([OH:66])[O-:67].[CH3:30][c:31]1[c:32]([C:37](=[O:38])[OH:39])[nH:33][c:34](=[O:36])[nH:35]1.[CH3:74][CH2:75][O:76][C:77](=[O:78])[CH3:79].[CH:1]([N:2]([CH2:3][CH3:4])[CH:5]([CH3:6])[CH3:7])([CH3:8])[CH3:9].[NH2:10][CH2:11][c:12]1[c:13]([F:29])[c:14]([O:19][c:20]2[cH:21][c:22]([C:23]#[N:24])[cH:25][c:26]([Cl:28])[cH:27]2)[c:15]([Cl:18])[cH:16][cH:17]1.[Na+:68].[O:69]=[CH:70][N:71]([CH3:72])[CH3:73].[P-:40]([F:41])([F:42])([F:43])([F:44])([F:45])[F:46].[n:47]1([O:48][C:49]([N:50]([CH3:51])[CH3:52])=[N+:53]([CH3:54])[CH3:55])[c:56]2[n:57][cH:58][cH:59][cH:60][c:61]2[n:62][n:63]1>>[NH:10]([CH2:11][c:12]1[c:13]([F:29])[c:14]([O:19][c:20]2[cH:21][c:22]([C:23]#[N:24])[cH:25][c:26]([Cl:28])[cH:27]2)[c:15]([Cl:18])[cH:16][cH:17]1)[C:37]([c:32]1[c:31]([CH3:30])[nH:35][c:34](=[O:36])[nH:33]1)=[O:38]
참가 물질출처 및 근거반응 노트

참가 물질

10

반응물 9

HCID 769Bicarbonate IonHCID 923Sodium IonHCID 6228DimethylformamideHCID 8857Ethyl AcetateHCID 9886HexafluorophosphateHCID 81531DiisopropylethylamineHCID 4641409(Dimethylamino)-N,N-dimethyl(3H-(1,2,3)triazolo(4,5-b)pyridin-3-yloxy)methaniminium
HCID 13558567
5-methyl-2-oxo-2,3-dihydro-1H-imidazole-4-carboxylic acid
HCID 594513923-{[3-(Aminomethyl)-6-chloro-2-fluorophenyl]oxy}-5-chlorobenzonitrile

생성물 1

HCID 68485337HCID 68485337, 화합물

출처 및 근거

ORD 기록
ord-9fdb4749a23443a5b168e5aed8bcfb41
출처 데이터셋
Validation data from https://doi.org/10.1039/C8SC04228D
DOI
10.1039/C8SC04228D

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