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. 2021 Feb 3;29(3):223–235. doi: 10.1016/j.jsps.2021.01.006

Table 2.

1H NMR chemical shifts (δ/ppm), chemical shifts variation (Δδ/ppm) and coupling constants (J/Hz) of clausenidin protons upon complexation with HPβCD.

Proton No. Free with HPβCD Diff. in chem. Shifit Clausenidin Complex J
δ0 δ δ − δ0 Hz
H1 1.6 1.62 −0.02 640 648 −8
H2 5.25 5.2 0.05 2100 2080 20
H3 2.3 2.25 0.05 920 900 20
H4 2.3 2.22 0.08 920 888 32
H5 2.17 2.16 0.01 868 864 4
H6 2.17 2.16 0.01 868 864 4
H7 1.45 1.44 0.01 580 576 4
H9 1.8 0.95 0.85 720 380 340
H10 1.98 0.97 1.01 792 388 404
H11 1.12 1.07 0.05 448 428 20
H12 0.94 1.08 −0.14 376 432 −56
H13 5.75 4.79 0.96 2300 1916 384
H14 5.82 4.95 0.87 2328 1980 348
H15 4.67 4.59 −0.08
H16 3.99 3.02 −0.97 355 1650 −1295
H17 1.35 1.22 0.13 2100 810 −1290
H18 2.11 2.41 −0.3 405 577 −172
H19 2.01 2.34 0.33 2010 452 −1558
H20 2.84 2.78 −0.06 540 647 −107
H21 1.71 1.76 0.05 621 1020 −399
H22 2.51 2.59 0.08 712 1002 −290