13C NMR Spectrum (1D, 25 MHz, H2O, predicted) (NP0291044)
Spectrum Details
| NP-MRD ID: | NP0291044 |
|---|---|
| Compound name: | 5-[hydroxy(3-hydroxy-4-methoxyphenyl)methyl]-6,6-dimethyl-2h,5h,7h,8h-[1,3]dioxolo[4,5-g]isoquinolin-6-ium |
| Spectrum type: | 13C NMR Spectrum (1D, 25 MHz, H2O, predicted) |
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| Peak Assignment Table | |||||||
|---|---|---|---|---|---|---|---|
| Row No. | Cluster Midpoint | No. Peaks | Coupling Type | No. C's | Atom No. | Peak Centers (ppm) | |
| 1 | 147.78 | 1 | s | 1 | 13 | 147.78 | |
| 2 | 147.61 | 1 | s | 1 | 3 | 147.61 | |
| 3 | 147.29 | 1 | s | 1 | 12 | 147.29 | |
| 4 | 146.21 | 1 | s | 1 | 25 | 146.21 | |
| 5 | 138.21 | 1 | s | 1 | 15 | 138.21 | |
| 6 | 133.62 | 1 | s | 1 | 6 | 133.62 | |
| 7 | 130.10 | 1 | s | 1 | 10 | 130.10 | |
| 8 | 124.08 | 1 | s | 1 | 5 | 124.08 | |
| 9 | 114.56 | 1 | s | 1 | 24 | 114.56 | |
| 10 | 112.00 | 1 | s | 1 | 4 | 112.00 | |
| 11 | 111.52 | 1 | s | 1 | 11 | 111.52 | |
| 12 | 110.47 | 1 | s | 1 | 14 | 110.47 | |
| 13 | 101.35 | 1 | s | 1 | 22 | 101.35 | |
| 14 | 73.63 | 1 | s | 1 | 7 | 73.63 | |
| 15 | 71.60 | 1 | s | 1 | 9 | 71.60 | |
| 16 | 62.53 | 1 | s | 1 | 17 | 62.53 | |
| 17 | 56.09 | 1 | s | 1 | 1 | 56.09 | |
| 18 | 48.45 | 1 | s | 2 | 19 20 | 48.45 | |
| 19 | 28.05 | 1 | s | 1 | 16 | 28.05 | |
Experimental Conditions
| Solvent: | H2O |
|---|---|
| Nucleus: | 13C |
| Frequency: | 100 MHz |
Documentation
| Document Description | Download | File Size |
|---|---|---|
| Peak List (TXT) | Download file | 1.04 KB |
| Peak Assignments (TXT) | Download file | 791 Bytes |
| Spectra Image with Peak Assignments | Not Available | Not Available |
| Raw Spectrum Image | Not Available | Not Available |
| nmrML File (NMRML) | Download file | 558 KB |
| JCAMP-DX File (JDX) | Download file | 154 KB |
| Raw Free Induction Decay file for spectral processing | Not Available | Not Available |
| Validation Report | Not Available | Not Available |
References
Not Available