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Carbon-13 NMR chemical shifts in some substituted 1,2,4-triazol-3-ones

✍ Scribed by William M. Litchman; Ulrich Hollstein; E. Paul Papadopoulos


Publisher
John Wiley and Sons
Year
1978
Tongue
English
Weight
643 KB
Volume
11
Category
Article
ISSN
0749-1581

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✦ Synopsis


Abstract

Carbon‐13 NMR data for 15 substituted 1,2,4‐triazol‐3‐ones are presented and discussed with regard to enolization in the neutral molecules. The coupling constant and chemical shift data show that the proton at N‐2 is not exchanging rapidly in the DMSO‐d~6~ solvent. Using D~2~OOD^−^ as a solvent, it is found that the C‐3 and C‐5 resonances are shifted downfield by nearly the same amount, suggesting that the proton at N‐4 is being removed. Enolization in the neutral molecules does not occur to any significant extent.


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