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Experimental and calculated 13 C chemical shifts for α‐, β‐, γ‐ and δ‐carbolines
Author(s) -
Corbally Roger P.,
Mehta Lina K.,
Parrick John,
Short Eric L.
Publication year - 2000
Publication title -
magnetic resonance in chemistry
Language(s) - English
Resource type - Journals
SCImago Journal Rank - 0.483
H-Index - 72
eISSN - 1097-458X
pISSN - 0749-1581
DOI - 10.1002/1097-458x(200012)38:12<1034::aid-mrc783>3.0.co;2-m
Subject(s) - chemistry , chemical shift , carbon 13 nmr , computational chemistry , stereochemistry
The 13 C NMR chemical shifts of the four carbolines 1,2,3,4‐tetrahydro‐β‐carboline, 6,7,8,9‐tetrahydro‐δ‐carboline, 3‐ethyl‐4‐azaindole and 5‐azaindole were assigned from various one‐ and two‐dimensional 1 H and 13 C NMR spectra. Comparison is made with the results of DFT/GIAO shielding calculations. Copyright © 2000 John Wiley & Sons, Ltd.