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. 2024 Jan 12;12(4):1666–1680. doi: 10.1021/acssuschemeng.3c07236

Table 5. Functional Groups Content for Selected Lignins Isolated Using Acid-Free Organosolv Treatments (A20 Series). Data Have Been Derived by Quantifying HSQC Spectra on the Basis of Quantitative 13C NMR Measurements35,40.

motif A20-1 [mmol/g] A20-3 [mmol/g] A20-4 [mmol/g] A20-6 [mmol/g] A20-7 [mmol/g] A20-9 [mmol/g] A20-10 [mmol/g] A20-12 [mmol/g]
G-ring (HSQC) 0.12 0.10 0.39 0.23 0.11 0.09 0.06 0.04
S ring (HSQC) 0.58 0.62 0.73 0.67 0.27 0.22 0.54 0.57
-OMe (13C) 8.72 8.34 8.29 9.22 7.51 7.16 8.07 7.05
Quat. Phe C-OMe (13C) (V) 8.72 8.12 9.24 10.12 8.40 7.76 9.27 9.42
β-O-4′ (G) (HSQC) (A) 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00
β-O-4′ (S) (HSQC) (B) 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00
β-β′ (HSQC) (C) 0.07 0.05 0.11 0.09 0.08 0.07 0.07 0.04
β-5′ (HSQC) (D) 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00
β-d-Xylanopyr. (HSQC) (G) 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00
BE (HSQC) (F) 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00
furan C3 type 1 (HSQC)a (I, II, III) 1.08 0.72 2.78 1.13 0.54 0.49 0.65 0.64
furan C4 type 1 (HSQC) (I, II, III) 0.32 0.26 0.70 0.55 0.21 0.24 0.29 0.37
furan C3 type 2 (HSQC) (IVa, IVb, V) 0.44 0.38 1.08 0.95 0.39 0.48 0.65 0.76
furan C4 type 2 (HSQC) (IVa, IVb, V) 0.12 0.13 0.42 0.51 0.20 0.27 0.40 0.44
ketone (13C) (III) 0.03 0.31 0.05 0.12 0.21 0.40 0.16 0.47
ester (13C) (E) 0.00 0.00 0.00 0.00 0.00 0.01 0.01 0.02
furan aldehyde (HSQC) (I, IVa, IVb) 0.07 0.14 0.14 0.32 0.20 0.34 0.47 0.47
S:G (pyr-GC/MS) 83:17 86:14 65:35 74:26 71:29 71:29 90:10 93:7
a

Potential overlap. Furan C3,4 and overlap with substituted G. Not included in the Phe/fur ratio (HSQC).