Acetic Acid → HCID 15117210, compound

HRID 214344Notes

Reaction equation

HRID 214344 reaction equation
[C:12]([CH3:13])(=[O:14])[N:15]1[CH2:16][CH2:17][C:18](=[O:21])[CH2:19][CH2:20]1.[CH2:7]([Li:8])[CH2:9][CH2:10][CH3:11].[CH3:1][Si:2]([CH3:3])([CH3:4])[C:5]#[CH:6].[CH3:29][CH2:30][CH2:31][CH2:32][CH2:33][CH3:34].[CH3:35][CH2:36][O:37][C:38](=[O:39])[CH3:40].[CH3:41][C:42](=[O:43])[OH:44].[Cl-:22].[NH4+:23].[O:24]1[CH2:25][CH2:26][CH2:27][CH2:28]1>>[CH3:1][Si:2]([CH3:3])([CH3:4])[C:5]#[C:6][C:18]1([OH:21])[CH2:17][CH2:16][N:15]([C:12]([CH3:13])=[O:14])[CH2:20][CH2:19]1

Participants

10

Reactant 9

HCID 176Acetic AcidHCID 223AmmoniumHCID 312ChlorideHCID 8028TetrahydrofuranHCID 8058HexaneHCID 8857Ethyl AcetateHCID 66111TrimethylsilylacetyleneHCID 122563N-Acetyl-4-piperidoneHCID 178418339Butyllithium

Product 1

HCID 15117210HCID 15117210, compound

Sources & evidence

ORD record
ord-eee69e244df14e2fa5a38e245c1bfb2c
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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