Anisole (C7 H8 O)
Authors: Sally Ralph, John Ralph, Larry L. Landucci
From: NMR Database of Lignin and Cell Wall Model Compounds.
Natural Isotopic formula weight: 108.13782
This is of the category: Monomers
Concentration: 80 mg/ml (Source: Aldrich)
Spectrometer: Bruker WM - 250 MHz
Assigned chemical shifts
| Atom ID | Author Nomenclature | Value | Ambiguity Code |
|---|---|---|---|
| C1 | OMe | 55.08 | 1 |
| C5 | 3 | 113.92 | 1 |
| C6 | 5 | 113.92 | 1 |
| C2 | 1 | 120.64 | 1 |
| C3 | 2 | 129.52 | 1 |
| C4 | 6 | 129.52 | 1 |
| C7 | 4 | 159.60 | 1 |
| H9 | OMe | 3.77 | 1 |
| H10 | OMe | 3.77 | 1 |
| H11 | OMe | 3.77 | 1 |
| H15 | 3 | 6.90 | 1 |
| H16 | 5 | 6.90 | 1 |
| H12 | 1 | 6.90 | 1 |
| H13 | 2 | 7.27 | 1 |
| H14 | 6 | 7.27 | 1 |
| Atom ID | Author Nomenclature | Value | Ambiguity Code |
|---|---|---|---|
| C1 | OMe | 55.28 | 1 |
| C5 | 3 | 114.62 | 1 |
| C6 | 5 | 114.62 | 1 |
| C2 | 1 | 121.19 | 1 |
| C3 | 2 | 130.14 | 1 |
| C4 | 6 | 130.14 | 1 |
| C7 | 4 | 160.63 | 1 |
| Atom ID | Author Nomenclature | Value | Ambiguity Code |
|---|---|---|---|
| C1 | OMe | 54.86 | 1 |
| C5 | 3 | 113.84 | 1 |
| C6 | 5 | 113.84 | 1 |
| C2 | 1 | 120.39 | 1 |
| C3 | 2 | 129.39 | 1 |
| C4 | 6 | 129.39 | 1 |
| C7 | 4 | 159.24 | 1 |