[1] Grant D M, Paul E G. Carbon-13 magnetic resonance II. Chemical shift data for the alkanes[J]. J A Chem Soc, 1964, 86: 2 984-2 990.
[2] Lindeman L P, Adams J Q. Carbon-13 nuclear magnetic shifts for the resonance spectrometry. Chemical shifts for the paraffins through C9[J]. Anal Chem, 1971, 43: 1 245-1 252.
[3] Clerc J T, Sommerauer H A. Minicomputer program based on additivity rules for the estimation of 13C NMR chemical shifts[J]. Anal Chim Acta, 1977, 95: 33-40.
[4] Jurs P C, Ball J W, Anker L S, et al. Carbon-13 nuclear magnetic resonance spectrum simulation[J]. J Chem Inf Comp Sci, 1992, 32: 272-278.
[5] Nuzillard J M. Computer-assisted structure determination of organic molecules[J]. J Chim Phys-Chim Biol, 1998, 95: 169-177.
[6] Meiler J, Meusinger R, Will M. Fast determination of 13C NMR chemical shifts using artificial neural networks[J]. J Chem Inf Comp Sci, 2000, 40: 1 169-1 176.
[7] Hall L H, Kier L B. Electrotopological state index for atom types: a novel combination of electronic, topological, and valence state information[J]. J Chem Inf Comp Sci, 1995, 35: 1 039-1 045.
[8] Li Z L(李志良),Pen H J(彭海蛟),Zhou L P(周丽平), et al. On VADE Characterization and 13C NMR Simulation for Amino Acids(氨基酸原子电距矢量表达及核磁共振碳谱模拟)[J]. Chinese J Magn Reson(波谱学杂志), 1999,16(6):553-558.
[9] Zhang M J(张梦军), Liao C Y(廖春阳), Zhou L P(周丽平), et al. On Preliminary Approach to Estimation and Prediction of Chemical Shift of 13C NMR Spectroscopy in Flavonoids on Vector of Atomic Flectronegative Distance(VAED)(黄酮类化合物的原子电距矢量表达及核磁共振碳谱)
[J]. Chinese J Magn Reson(波谱学杂志), 2002, 19(3): 293-300.
[10] Yu D Q(于德泉), Yang J S(杨峻山), Xie J X(谢晶曦). Handbook of Analytical Chemistry: Vol.5. Spectroscopy of nuclear magnetic resonance(分析化学手册第五分册:核磁共振波谱分析)[M]. Beijing(北京): Chemical Industry Press(化学工业出版社), 1989:832-834.
[11] Shen Q F(沈其丰). Carbon-13 spectrometry of nuclear magnetic resonance(核磁共振碳谱)[M]. Beijing(北京):Peking University Press(北京大学出版社).1988:267-270. |