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. 2016 May 6;11(5):e0155265. doi: 10.1371/journal.pone.0155265

Table 2. 1H-NMR (400 MHz) and 13C-NMR (100 MHz) spectral data of isoasarone 2 in CDCl3.

Position 1H 13C
δH (multiplicity, J in Hz) δC
Experimental(CDCl3) Reference [24](CDCl3) Experimental(CDCl3) Reference [24](CDCl3)
1 - - 120.2 120.3
2 6.70 (s) 6.70 (s) 114.1 114.3
3 - - 143.2 143.3
4 - - 148.1 148.2
5 6.54 (s) 6.54 (s) 98.2 98.4
6 - - 151.5 151.6
1’ 3.30 (d, 6.4) 3.30 (dm, 6.4) 33.8 33.8
2’ 5.92–6.02 (m) 5.97 (m) 137.5 137.5
3’ 5.02–5.07 (m) 5.04 (m) 115.4 115.4
3-OMe 3.84 (s) 3.83 (s) 56.8 56.8
4-OMe 3.89 (s) 3.88 (s) 56.4 56.5
6-OMe 3.81 (s) 3.81 (s) 56.8 56.8