13C NMR Spectrum (1D, 201 MHz, D2O, predicted) (NP0055302)
Spectrum Details
| NP-MRD ID: | NP0055302 |
|---|---|
| Compound name: | Calomelanone |
| Spectrum type: | 13C NMR Spectrum (1D, 201 MHz, D2O, 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 | 170.73 | 1 | s | 1 | 12 | 170.73 | |
| 2 | 167.80 | 1 | s | 1 | 19 | 167.80 | |
| 3 | 159.41 | 1 | s | 1 | 15 | 159.41 | |
| 4 | 159.41 | 1 | s | 1 | 3 | 159.41 | |
| 5 | 136.58 | 1 | s | 1 | 6 | 136.58 | |
| 6 | 132.53 | 1 | s | 1 | 21 | 132.53 | |
| 7 | 131.07 | 1 | s | 1 | 5 | 131.07 | |
| 8 | 124.69 | 1 | s | 1 | 22 | 124.69 | |
| 9 | 111.82 | 1 | s | 1 | 4 | 111.82 | |
| 10 | 109.24 | 1 | s | 1 | 11 | 109.24 | |
| 11 | 97.78 | 1 | s | 1 | 18 | 97.78 | |
| 12 | 97.78 | 1 | s | 1 | 14 | 97.78 | |
| 13 | 55.52 | 1 | s | 1 | 17 | 55.52 | |
| 14 | 55.52 | 1 | s | 1 | 1 | 55.52 | |
| 15 | 38.33 | 1 | s | 1 | 8 | 38.33 | |
| 16 | 31.90 | 1 | s | 1 | 7 | 31.90 | |
Experimental Conditions
| Solvent: | D2O |
|---|---|
| Nucleus: | 13C |
| Frequency: | 800 MHz |
Documentation
| Document Description | Download | File Size |
|---|---|---|
| Peak List (TXT) | Download file | 846 Bytes |
| Peak Assignments (TXT) | Download file | 641 Bytes |
| Spectra Image with Peak Assignments | Not Available | Not Available |
| Raw Spectrum Image | Not Available | Not Available |
| nmrML File (NMRML) | Download file | 556 KB |
| JCAMP-DX File (JDX) | Download file | 151 KB |
| Raw Free Induction Decay file for spectral processing | Not Available | Not Available |
| Validation Report | Not Available | Not Available |
References
Not Available