Lignin_cw_compound_3061 (C18 H18 O6)
Authors: Sally Ralph, John Ralph, Larry L. Landucci
From: NMR Database of Lignin and Cell Wall Model Compounds.
Natural Isotopic formula weight: 330.33192
This is of the category: b-5 Dimers
Concentration: Saturated (Source: Sally Ralph)
Spectrometer: Bruker DRX - 360 MHz
Assigned chemical shifts
| Atom ID | Author Nomenclature | Value | Ambiguity Code |
|---|---|---|---|
| C13 | B | 53.84 | 1 |
| C1 | AOMe | 56.30 | 1 |
| C2 | BOMe | 56.37 | 1 |
| C9 | G | 64.22 | 1 |
| C17 | A | 89.87 | 1 |
| C7 | A2 | 110.65 | 1 |
| C6 | B2 | 113.44 | 1 |
| C4 | A5 | 115.79 | 1 |
| C3 | A6 | 119.82 | 1 |
| C5 | B6 | 121.43 | 1 |
| C12 | B5 | 131.19 | 1 |
| C10 | B1 | 132.40 | 1 |
| C11 | A1 | 133.42 | 1 |
| C16 | B3 | 145.81 | 1 |
| C14 | A4 | 147.67 | 1 |
| C15 | A3 | 148.49 | 1 |
| C18 | B4 | 154.87 | 1 |
| C8 | BA | 190.90 | 1 |
| H39 | B | 3.67 | 1 |
| H25 | AOMe | 3.82 | 1 |
| H26 | AOMe | 3.82 | 1 |
| H27 | AOMe | 3.82 | 1 |
| H28 | BOMe | 3.92 | 1 |
| H29 | BOMe | 3.92 | 1 |
| H30 | BOMe | 3.92 | 1 |
| H37 | G | 3.92 | 1 |
| H38 | G | 3.92 | 1 |
| H40 | A | 5.69 | 1 |
| H32 | A5 | 6.81 | 1 |
| H31 | A6 | 6.88 | 1 |
| H35 | A2 | 7.05 | 1 |
| H34 | B2 | 7.42 | 1 |
| H33 | B6 | 7.53 | 1 |
| H42 | AOH | 7.65 | 1 |
| H36 | BA | 9.82 | 1 |