Methyl Ferulate (C11 H12 O4)
Authors: Sally Ralph, John Ralph, Larry L. Landucci
From: NMR Database of Lignin and Cell Wall Model Compounds.
Natural Isotopic formula weight: 208.21058
This is of the category: Monomers
Concentration: 108 mg/ml (Source: John Ralph)
Spectrometer: Bruker WM - 250 MHz
Assigned chemical shifts
| Atom ID | Author Nomenclature | Value | Ambiguity Code |
|---|---|---|---|
| C2 | GOMe | 51.60 | 1 |
| C1 | 3OMe | 55.93 | 1 |
| C7 | 2 | 109.56 | 1 |
| C6 | B | 114.86 | 1 |
| C5 | 5 | 115.09 | 1 |
| C3 | 6 | 123.00 | 1 |
| C8 | 1 | 126.92 | 1 |
| C4 | A | 145.03 | 1 |
| C10 | 3 | 146.89 | 1 |
| C9 | 4 | 148.11 | 1 |
| C11 | G | 167.80 | 1 |
| H21 | GOMe | 3.79 | 1 |
| H20 | GOMe | 3.79 | 1 |
| H19 | GOMe | 3.79 | 1 |
| H17 | 3OMe | 3.89 | 1 |
| H18 | 3OMe | 3.89 | 1 |
| H16 | 3OMe | 3.89 | 1 |
| H26 | 2 | 7.31 | 1 |
| H23 | A | 7.61 | 1 |
| H24 | 5 | 6.90 | 1 |
| H22 | 6 | 7.05 | 1 |
| H25 | B | 6.28 | 1 |
| Atom ID | Author Nomenclature | Value | Ambiguity Code |
|---|---|---|---|
| C2 | GOMe | 51.47 | 1 |
| C1 | 3OMe | 56.32 | 1 |
| C7 | 2 | 111.34 | 1 |
| C6 | B | 115.51 | 1 |
| C5 | 5 | 116.03 | 1 |
| C3 | 6 | 123.78 | 1 |
| C8 | 1 | 127.38 | 1 |
| C4 | A | 145.65 | 1 |
| C10 | 3 | 148.66 | 1 |
| C9 | 4 | 149.99 | 1 |
| C11 | G | 167.82 | 1 |
| Atom ID | Author Nomenclature | Value | Ambiguity Code |
|---|---|---|---|
| C2 | GOMe | 51.12 | 1 |
| C1 | 3OMe | 55.68 | 1 |
| C7 | 2 | 111.32 | 1 |
| C6 | B | 114.19 | 1 |
| C5 | 5 | 115.54 | 1 |
| C3 | 6 | 122.99 | 1 |
| C8 | 1 | 125.56 | 1 |
| C4 | A | 145.02 | 1 |
| C10 | 3 | 147.92 | 1 |
| C9 | 4 | 149.38 | 1 |
| C11 | G | 167.02 | 1 |