13C NMR Spectrum (1D, 50 MHz, H2O, predicted) (NP0187345)
Spectrum Details
| NP-MRD ID: | NP0187345 |
|---|---|
| Compound name: | 3-(2h-1,3-benzodioxol-5-yl)-6-methoxy-7-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}chromen-4-one |
| Spectrum type: | 13C NMR Spectrum (1D, 50 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 | 175.09 | 1 | s | 1 | 6 | 175.09 | |
| 2 | 157.39 | 1 | s | 1 | 20 | 157.39 | |
| 3 | 152.35 | 1 | s | 1 | 18 | 152.35 | |
| 4 | 152.10 | 1 | s | 1 | 22 | 152.10 | |
| 5 | 147.71 | 1 | s | 2 | 12 13 | 147.71 | |
| 6 | 146.50 | 1 | s | 1 | 3 | 146.50 | |
| 7 | 124.93 | 1 | s | 1 | 9 | 124.93 | |
| 8 | 123.30 | 1 | s | 1 | 8 | 123.30 | |
| 9 | 122.49 | 1 | s | 1 | 10 | 122.49 | |
| 10 | 119.28 | 1 | s | 1 | 5 | 119.28 | |
| 11 | 111.93 | 1 | s | 1 | 14 | 111.93 | |
| 12 | 109.47 | 1 | s | 1 | 4 | 109.47 | |
| 13 | 108.85 | 1 | s | 1 | 11 | 108.85 | |
| 14 | 100.87 | 1 | s | 1 | 16 | 100.87 | |
| 15 | 99.70 | 1 | s | 1 | 24 | 99.70 | |
| 16 | 97.47 | 1 | s | 1 | 21 | 97.47 | |
| 17 | 77.76 | 1 | s | 1 | 26 | 77.76 | |
| 18 | 77.51 | 1 | s | 1 | 31 | 77.51 | |
| 19 | 73.10 | 1 | s | 1 | 33 | 73.10 | |
| 20 | 70.94 | 1 | s | 1 | 29 | 70.94 | |
| 21 | 61.84 | 1 | s | 1 | 27 | 61.84 | |
| 22 | 55.90 | 1 | s | 1 | 1 | 55.90 | |
Experimental Conditions
| Solvent: | H2O |
|---|---|
| Nucleus: | 13C |
| Frequency: | 200 MHz |
Documentation
| Document Description | Download | File Size |
|---|---|---|
| Peak List (TXT) | Download file | 1.21 KB |
| Peak Assignments (TXT) | Download file | 822 Bytes |
| Spectra Image with Peak Assignments | Not Available | Not Available |
| Raw Spectrum Image | Not Available | Not Available |
| nmrML File (NMRML) | Download file | 559 KB |
| JCAMP-DX File (JDX) | Download file | 153 KB |
| Raw Free Induction Decay file for spectral processing | Not Available | Not Available |
| Validation Report | Not Available | Not Available |
References
Not Available