摘要
本文基于化学位移加和性理论,建立了一个经验公式,利用所得公式计算了9个化合物的δ_C值,计算值与文献值符合良好,并对32个化合物的^(13)C NMR化学位移进行了预测。
Emperical formulas were set up according to the additive theory of chemical shift in this paper. The chemical shifts of 9 quinoline alkaloids were calculated using the proposed emperical formula. Calculated and experimental shifts are in excellent agreement. The chemical shifts of 32 compounds were predicted in addition.
出处
《波谱学杂志》
CAS
CSCD
1993年第4期447-451,共5页
Chinese Journal of Magnetic Resonance