Lignin_cw_compound_3045 (C11 H14 O3)
Authors: Sally Ralph, John Ralph, Larry L. Landucci
From: NMR Database of Lignin and Cell Wall Model Compounds.
Natural Isotopic formula weight: 194.22706
This is of the category: Misc. Compounds
Concentration: Saturated (Source: Sally Ralph)
Spectrometer: Bruker DRX - 360 MHz
Assigned chemical shifts
| Atom ID | Author Nomenclature | Value | Ambiguity Code |
|---|---|---|---|
| C3 | B | 26.11 | 1 |
| C5 | G | 30.33 | 1 |
| C4 | A | 33.51 | 1 |
| C1 | 5OMe | 56.73 | 1 |
| C2 | 3OMe | 59.83 | 1 |
| C6 | 6 | 104.24 | 1 |
| C8 | 2 | 128.60 | 1 |
| C7 | 1 | 134.89 | 1 |
| C10 | 4 | 138.17 | 1 |
| C11 | 3 | 144.71 | 1 |
| C9 | 5 | 148.47 | 1 |
| H21 | B | 1.98 | 1 |
| H22 | B | 1.98 | 1 |
| H23 | A | 2.78 | 1 |
| H24 | A | 2.78 | 1 |
| H25 | G | 2.83 | 1 |
| H26 | G | 2.83 | 1 |
| H17 | 5OMe | 3.77 | 1 |
| H16 | 5OMe | 3.77 | 1 |
| H15 | 5OMe | 3.77 | 1 |
| H18 | 3OMe | 3.79 | 1 |
| H19 | 3OMe | 3.79 | 1 |
| H20 | 3OMe | 3.79 | 1 |
| H27 | 6 | 6.58 | 1 |
| Atom ID | Author Nomenclature | Value | Ambiguity Code |
|---|---|---|---|
| H21 | B | 1.86 | 1 |
| H22 | B | 1.86 | 1 |
| H23 | A | 2.71 | 1 |
| H24 | A | 2.71 | 1 |
| H25 | G | 2.86 | 1 |
| H26 | G | 2.86 | 1 |
| H17 | 5OMe | 3.28 | 1 |
| H16 | 5OMe | 3.28 | 1 |
| H15 | 5OMe | 3.28 | 1 |
| H18 | 3OMe | 3.75 | 1 |
| H19 | 3OMe | 3.75 | 1 |
| H20 | 3OMe | 3.75 | 1 |
| H27 | 6 | 6.32 | 1 |