Hydrochloric Acid → Hydrochloric Acid

HRID 694280Notes

Reaction equation

HRID 694280 reaction equation
[CH2:1]([O:2][C:3](=[O:4])[N:11]1[CH2:12][c:13]2[n:14]([CH2:24][c:25]3[cH:26][cH:27][c:28]([C:31]([F:32])([F:33])[F:34])[cH:29][cH:30]3)[c:15]3[cH:16][cH:17][cH:18][cH:19][c:20]3[c:21]2[CH2:22][CH2:23]1)[c:5]1[cH:6][cH:7][cH:8][cH:9][cH:10]1.[CH3:36][OH:37].[ClH:35].[O:38]1[CH2:39][CH2:40][O:41][CH2:42][CH2:43]1>>[ClH:35].[NH:11]1[CH2:12][c:13]2[n:14]([CH2:24][c:25]3[cH:26][cH:27][c:28]([C:31]([F:32])([F:33])[F:34])[cH:29][cH:30]3)[c:15]3[cH:16][cH:17][cH:18][cH:19][c:20]3[c:21]2[CH2:22][CH2:23]1

Participants

6

Reactant 4

HCID 313Hydrochloric AcidHCID 887MethanolHCID 312751,4-DioxaneHCID 120692942-benzyloxycarbonyl-9-{[4-(trifluoromethyl)phenyl]methyl}-1,3,4,9-tetrahydro-2H-pyrido[3,4-b]indole

Product 2

HCID 313Hydrochloric AcidHCID 120692959-[[4-(Trifluoromethyl)phenyl]methyl]-1,2,3,4-tetrahydropyrido[3,4-b]indole

Sources & evidence

ORD record
ord-0cd4556a997341e7a23e0a8f7b5223b6
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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