Fig. 3: Application of i-HMBC/D-i-HMBC methodology to identify the two-bond HMBC correlation of H9-C3 in linalool (2).

a nominal HMBC of H9; b i-HMBC of H9; c D-i-HMBC of H9 (2JCH are in red, the most downfield 4JCH are in blue, the isotope shift difference are in magenta); methods to determine chemical shift (d) peak picking, (e) line fitting (blue: fitted peak; pink: sum of fitted peak; red: fitting residue); f stack of horizontal slices of i-HMBC correlations from H9, showing measurements of isotope shift differences.