ChemInform Abstract: DETERMINATION OF THE CONFORMATION OF SUBSTITUTED 4,6-DIOXO-1,3-DIOXANES. PART III. CARBON-13 NMR CHEMICAL SHIFTS, 13C,H COUPLING CONSTANTS AND SPIN-LATTICE RELAXATION TIMES OF 2-, 2,2-, 2,5-, AND 2,2,5-SUBSTITUTED DERIVATIVES

1977 ◽  
Vol 8 (14) ◽  
pp. no-no
Author(s):  
P. AEYRAES
Keyword(s):  
Chemical Shifts ◽  
Relaxation Times ◽  
Lattice Relaxation ◽  
Coupling Constants ◽  
Spin Lattice Relaxation ◽  
Nmr Chemical Shifts ◽  
Spin Lattice

The conformational equilibrium in [13C-1-methyl]-cis-1,4-dimethylcyclohexane

1980 ◽  
Vol 58 (23) ◽  
pp. 2709-2713 ◽  
Author(s):  
Harold Booth ◽  
Jeremy Ramsey Everett
Keyword(s):  
Conformational Equilibrium ◽  
Chemical Shifts ◽  
Relaxation Times ◽  
Lattice Relaxation ◽  
Coupling Constants ◽  
Spin Lattice Relaxation ◽  
Spin Lattice ◽  
Nuclear Overhauser ◽  
In Cis ◽  
C Nmr

The conformational equilibrium in [13C-1-methyl]-cis-1,4-dimethylcyclohexane has been assessed by (a) direct integration of signals due to equatorial and axial methyl carbons in the 13C nmr spectrum at 172 K and (b) by measurement of the 13C chemical shifts of C-1 and C-4 in the spectrum at 300 K. It is concluded that a 13C isotope effect on the position of the degenerate equilibrium in cis-1,4-dimethylcyclohexane is either nonexistent, or is too small to be detected by methods of analyses employed. The 13C nmr data incidental to the study (chemical shifts, coupling constants, spin–lattice relaxation times, nuclear Overhauser enhancements, and 1-bond isotope shifts) are recorded for the title compound and its trans-isomer.

Conformation of ring A in triterpenoid ketones. Carbon-13 chemical shifts and spin-lattice relaxation times of lupane and 18α-oleanane derivatives

1989 ◽  
Vol 54 (7) ◽  
pp. 1928-1939 ◽  
Author(s):  
Miloš Buděšínský ◽  
Jiří Klinot
Keyword(s):  
Chemical Shifts ◽  
Relaxation Times ◽  
Lattice Relaxation ◽  
Chair Conformation ◽  
Spin Lattice Relaxation ◽  
Spin Lattice ◽  
Structural Assignment ◽  
Boat Form ◽  
The One ◽  
C Nmr

13C NMR spectra of sixteen lupane and 19β,28-epoxy-18α-oleanane triterpenoids I-XVI were measured and a complete structural assignment of chemical shifts was made. For most compounds also the carbon spin-lattice relaxation times T1 were obtained. Characteristic differences in chemical shifts of some carbon atom signals were found between 2α-methyl-3-oxo and 2α-methyl-1-oxo derivatives II, V and VIII with chair conformation of the ring A on the one hand and their 2β-isomers III, VI and IX (boat form) on the other. Using these 2-methyl ketones as models, the chair-boat population in allobetulone (I), 3-oxo-28-lupanenitrile (IV) and 1-oxo derivative VII was determined. The results agree well with the data obtained by other physical methods.

Germanium-73 chemical shifts and spin-lattice relaxation times of some tetrasubstituted germanes

1984 ◽  
Vol 23 (23) ◽  
pp. 3835-3836 ◽  
Author(s):  
Yoshito Takeuchi ◽  
Toshie Harazono ◽  
Norihiro Kakimoto
Keyword(s):  
Chemical Shifts ◽  
Relaxation Times ◽  
Lattice Relaxation ◽  
Spin Lattice Relaxation ◽  
Spin Lattice

A Selective Determination of the Proton Nuclear Relaxation Times of the Alkaloid Vindoline: An Extension via Fourier Transform Measurements

1974 ◽  
Vol 52 (5) ◽  
pp. 829-832 ◽  
Author(s):  
L. D. Hall ◽  
Caroline M. Preston
Keyword(s):  
Fourier Transform ◽  
Relaxation Times ◽  
Lattice Relaxation ◽  
Spin Lattice Relaxation ◽  
Nuclear Relaxation ◽  
Transform Method ◽  
Fourier Transform Method ◽  
Selective Determination ◽  
Spin Lattice

A Fourier Transform method has been used to measure the spin–lattice relaxation times of essentially all the protons of the alkaloid, vindoline. It is shown that even for a molecule of this size substantial and potentially useful differences exist in the experimental relaxation times which reflect the degree of crowding of each proton by other protons.

Synthesis of sugar-organometallic conjugales: ferrocenyl monosaccharide derivatives

1980 ◽  
Vol 58 (12) ◽  
pp. 1188-1197 ◽  
Author(s):  
Michael J. Adam ◽  
Laurance D. Hall
Keyword(s):  
Group Technology ◽  
Chemical Shifts ◽  
Soluble Sugar ◽  
Free Water ◽  
Lattice Relaxation ◽  
Proton Spin ◽  
Water Soluble ◽  
Coupling Constants ◽  
Spin Lattice Relaxation ◽  
Spin Lattice

Suitably blocked carbohydrates containing free thio 4, amino 5, and hydroxyl 10, 19 nucleophilic functionalities have been treated with (a) ferrocenecarbonyl chlorides 2 and 3, (b) N,N-dimethylaminomethylferrocene methiodide 12, and (c) ferrocenyl tosylate 16 to form the ferrocenyl sugar derivatives 6, 7, 8, 9, 11, 13, 14, 15, and 20. Direct conjugation of a free, water-soluble sugar to ferrocene was achieved by the formation of a Schiff's base between glucosamine hydrochloride 25 and ferrocene carboxaldehyde 24. The synthesis of ferrocenyl sugars using bridging group technology is exemplified by the conjugation of the thio sugar 4 to ferrocene via the versatile coupling reagent cyanuric chloride 21 to form the s-triazine compound 23. These products have been studied by 1H nmr spectroscopy: chemical shifts, coupling constants, and proton spin–lattice relaxation measurements.

A study of 14N relaxation and nitrogen–proton spin coupling in Watson–Crick base pair models through Fourier transform measurements on NH proton spin–lattice relaxation in the rotating frame

1979 ◽  
Vol 57 (9) ◽  
pp. 1075-1079 ◽  
Author(s):  
Michael E. Moseley ◽  
Peter Stilbs
Keyword(s):  
Relaxation Times ◽  
Lattice Relaxation ◽  
Proton Spin ◽  
Coupling Constants ◽  
Spin Coupling ◽  
Spin Lattice Relaxation ◽  
Indirect Measurements ◽  
Spin Lattice ◽  
Proton Coupling ◽  
Nuclear Spin Lattice Relaxation

Indirect measurements of nitrogen-14 nuclear spin-lattice relaxation times and direct proton coupling constants are presented together with carbon-13 T1 data for a series of alkyl-substituted nucleic acid bases and mixtures thereof in DMSO-d6. With the exception of the guanine NH nitrogen, which possibly experiences a decrease in the electric field gradient upon complexation with cytosine, no indications of significant changes in the electronic environment around the nitrogen nuclei were found for any combination of bases. Forsen–Hoffman spin saturation transfer experiments on the NH and NH2 protons are also presented.

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