Methane → HCID 18461028, compound

HRID 175043

Reaction equation

HRID 175043 reaction equation
[BH4-:85].[Br:17][c:18]1[cH:19][c:20]([CH:21]=[O:22])[cH:23][n:24][cH:25]1.[Br:1][c:2]1[cH:3][c:4]([CH2:5][CH:6]2[CH2:7][CH:8]3[CH2:9][CH2:10][N:11]2[CH2:12][CH2:13]3)[cH:14][n:15][cH:16]1.[Br:40][c:41]1[cH:42][c:43]([CH:47]=[C:48]2[N:49]3[CH2:50][CH2:51][CH:52]([C:53]2=[O:54])[CH2:55][CH2:56]3)[cH:44][n:45][cH:46]1.[C:38].[C:39].[CH3:87][OH:88].[CH:57]([BH-:58]([CH:59]([CH2:60][CH3:61])[CH3:62])[CH:63]([CH2:64][CH3:65])[CH3:66])([CH2:67][CH3:68])[CH3:69].[CH:71]([BH-:72]([CH:73]([CH2:74][CH3:75])[CH3:76])[CH:77]([CH2:78][CH3:79])[CH3:80])([CH2:81][CH3:82])[CH3:83].[ClH:26].[K+:37].[K+:84].[Li+:70].[N:27]12[CH2:28][CH2:29][CH:30]([CH2:31][CH2:32]1)[C:33](=[O:34])[CH2:35]2.[Na+:86].[O:89]1[CH2:90][CH2:91][CH2:92][CH2:93]1.[OH-:36].[cH:94]1[cH:95][cH:96][n:97][cH:98][cH:99]1>>[Br:40][c:41]1[cH:42][c:43]([CH2:47][CH:48]2[N:49]3[CH2:50][CH2:51][CH:52]([C:53]2=[O:54])[CH2:55][CH2:56]3)[cH:44][n:45][cH:46]1

Participants

16

Reactant 15

HCID 297Methane2×HCID 313Hydrochloric AcidHCID 813Potassium Cation2×HCID 887MethanolHCID 923Sodium ionHCID 961HydroxideHCID 1049PyridineHCID 8028TetrahydrofuranHCID 195073-QuinuclidinoneHCID 28123BorohydrideHCID 28486Lithium ionHCID 2723990Tri(butan-2-yl)boranuide2×HCID 27847345-Bromo-3-pyridinecarboxaldehydeHCID 129882222-((5-Bromo-3-pyridyl)methyl)-1-azabicyclo[2.2.2]octaneHCID 545251862-((5-Bromo-3-pyridinyl)methylene)-1-azabicyclo[2.2.2]octan-3-one

Product 1

HCID 18461028HCID 18461028, compound

Sources & evidence

ORD record
ord-3c4c93e1271942f092e141319cece400
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Linked notes

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