# Summary of NMR spectra ( SCF GIAO Magnetic shielding) # Values for element C only # Reference: TMS mPW1PW91/6-31G(d,p) CDCl3 GIAO # Reference shielding: 196.591 ppm # Degenerate peaks are condensed together (Degeneracy Tolerance 0.05) # # Shift (ppm) Degeneracy Atoms 171.5870000000 1.0000 3 137.1898000000 1.0000 5 130.1132000000 1.0000 10 74.1516000000 1.0000 7 69.9172000000 1.0000 6 57.2601000000 1.0000 8 56.2569000000 1.0000 9 35.4487000000 1.0000 1 30.8458000000 1.0000 2 18.6470000000 1.0000 13