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2-PHENYL-4-[D-ARABINO-4'-(4'''-BENZYLPIPERIDIN-1-YL)-3'-HYDROXY-O-1',2'-ISOPROPYLIDENEBUTYL]-2H-1,2,3-TRIAZOLE
SpectraBase Compound ID 8CACiF2AZsA
InChI InChI=1S/C27H34N4O3/c1-27(2)33-25(23-18-28-31(29-23)22-11-7-4-8-12-22)26(34-27)24(32)19-30-15-13-21(14-16-30)17-20-9-5-3-6-10-20/h3-12,18,21,24-26,32H,13-17,19H2,1-2H3/t24-,25-,26+/m1/s1
InChIKey WJSPUCHDTVTHPP-CYXNTTPDSA-N
Mol Weight 462.6 g/mol
Molecular Formula C27H34N4O3
Exact Mass 462.263091 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4zZzbxXhnmc
Name 2-PHENYL-4-[D-ARABINO-4'-(4'''-BENZYLPIPERIDIN-1-YL)-3'-HYDROXY-O-1',2'-ISOPROPYLIDENEBUTYL]-2H-1,2,3-TRIAZOLE
Compound Number 8
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C27H34N4O3
InChI InChI=1S/C27H34N4O3/c1-27(2)33-25(23-18-28-31(29-23)22-11-7-4-8-12-22)26(34-27)24(32)19-30-15-13-21(14-16-30)17-20-9-5-3-6-10-20/h3-12,18,21,24-26,32H,13-17,19H2,1-2H3/t24-,25-,26+/m1/s1
InChIKey WJSPUCHDTVTHPP-CYXNTTPDSA-N
Literature Reference Author HIMANSHU,R.TYAGI,C.E.OLSEN,W.ERRINGTON,V.S.PARMAR,A.K.PRASAD
Literature Reference Citation BIOORG.MED.CHEM.,10,963(2002)
Literature Reference DOI 10.1016/S0968-0896(01)00349-2
Molecular Weight 462.592 g/mol
Solvent CDCl3
Source File Reference UWLU31005