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Prediction of ortho(β) 13C chemical shifts in conjugated systems (1981)

Craik, D. J. ; Ternai, B.

Chichester : Wiley-Blackwell

Organic Magnetic Resonance 15 (1981), S. 268-272

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ISSN: 0030-4921

Keywords: Chemistry ; Analytical Chemistry and Spectroscopy

Source: Wiley InterScience Backfile Collection 1832-2000

Topics: Chemistry and Pharmacology

Notes: An equation has been developed which relates ortho or C-β 13C substituent chemical shifts (SCS) to the ortho proton-proton coupling constant in the unsubstituted member of a conjugated series. This method is an extension of previous equations which have been used to predict ortho 1H SCS values, and has its origin in a relationship between bond order and SCS values. The equation was derived from ortho 13C data in 2-naphthalenes and monosubstituted benzenes and its application to other unsaturated series is discussed.

Additional Material: 3 Tab.

Type of Medium: Electronic Resource

URL: http://dx.doi.org/10.1002/mrc.1270150311

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