Acetylated Ferulic Acid (C12 H12 O5)
Authors: Sally Ralph, John Ralph, Larry L. Landucci
From: NMR Database of Lignin and Cell Wall Model Compounds.
Natural Isotopic formula weight: 236.22068
This is of the category: Monomers
Concentration: 100 mg/ml (Source: Richard F. Helm)
Spectrometer: Bruker WM - 250 MHz
Assigned chemical shifts
| Atom ID | Author Nomenclature | Value | Ambiguity Code |
|---|---|---|---|
| H19 | AcMe | 2.33 | 1 |
| H18 | AcMe | 2.33 | 1 |
| H20 | AcMe | 2.33 | 1 |
| H22 | OMe | 3.88 | 1 |
| H23 | OMe | 3.88 | 1 |
| H21 | OMe | 3.88 | 1 |
| H25 | A | 7.04 | 1 |
| H27 | B | 6.41 | 1 |
| Atom ID | Author Nomenclature | Value | Ambiguity Code |
|---|---|---|---|
| C1 | AcMe | 20.48 | 1 |
| C2 | OMe | 56.42 | 1 |
| C7 | 2 | 112.48 | 1 |
| C4 | B | 119.48 | 1 |
| C3 | 6 | 122.03 | 1 |
| C5 | 5 | 124.11 | 1 |
| C9 | 1 | 134.38 | 1 |
| C10 | 4 | 142.62 | 1 |
| C6 | A | 144.79 | 1 |
| C11 | 3 | 152.71 | 1 |
| C12 | AcC=O | 167.70 | 1 |
| C12 | G | 168.78 | 1 |
| Atom ID | Author Nomenclature | Value | Ambiguity Code |
|---|---|---|---|
| C1 | AcMe | 20.29 | 1 |
| C2 | OMe | 55.90 | 1 |
| C7 | 2 | 111.79 | 1 |
| C4 | B | 119.47 | 1 |
| C3 | 6 | 121.20 | 1 |
| C5 | 5 | 123.10 | 1 |
| C9 | 1 | 133.19 | 1 |
| C10 | 4 | 140.77 | 1 |
| C6 | A | 143.23 | 1 |
| C11 | 3 | 151.09 | 1 |
| C12 | AcC=O | 167.50 | 1 |
| C12 | G | 168.29 | 1 |