13C NMR Spectrum (1D, 101 MHz, H2O, predicted) (NP0234463)
Spectrum Details
| NP-MRD ID: | NP0234463 |
|---|---|
| Compound name: | methyl (2s,3s,4s,5r,6s)-5-(acetyloxy)-3,4-dihydroxy-6-{[5-hydroxy-2-(4-hydroxyphenyl)-4-oxochromen-7-yl]oxy}oxane-2-carboxylate |
| Spectrum type: | 13C NMR Spectrum (1D, 101 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 | 181.90 | 1 | s | 1 | 14 | 181.90 | |
| 2 | 169.30 | 1 | s | 1 | 30 | 169.30 | |
| 3 | 168.90 | 1 | s | 1 | 3 | 168.90 | |
| 4 | 164.80 | 1 | s | 1 | 17 | 164.80 | |
| 5 | 162.63 | 1 | s | 1 | 9 | 162.63 | |
| 6 | 161.04 | 1 | s | 1 | 11 | 161.04 | |
| 7 | 160.88 | 1 | s | 1 | 21 | 160.88 | |
| 8 | 156.80 | 1 | s | 1 | 26 | 156.80 | |
| 9 | 126.60 | 1 | s | 1 | 24 | 126.60 | |
| 10 | 126.60 | 1 | s | 1 | 19 | 126.60 | |
| 11 | 121.20 | 1 | s | 1 | 18 | 121.20 | |
| 12 | 115.62 | 1 | s | 1 | 23 | 115.62 | |
| 13 | 115.62 | 1 | s | 1 | 20 | 115.62 | |
| 14 | 105.40 | 1 | s | 1 | 13 | 105.40 | |
| 15 | 104.30 | 1 | s | 1 | 16 | 104.30 | |
| 16 | 100.28 | 1 | s | 1 | 7 | 100.28 | |
| 17 | 99.70 | 1 | s | 1 | 10 | 99.70 | |
| 18 | 94.70 | 1 | s | 1 | 27 | 94.70 | |
| 19 | 76.30 | 1 | s | 1 | 5 | 76.30 | |
| 20 | 75.90 | 1 | s | 1 | 33 | 75.90 | |
| 21 | 73.95 | 1 | s | 1 | 28 | 73.95 | |
| 22 | 72.62 | 1 | s | 1 | 35 | 72.62 | |
| 23 | 51.41 | 1 | s | 1 | 1 | 51.41 | |
| 24 | 20.90 | 1 | s | 1 | 31 | 20.90 | |
Experimental Conditions
| Solvent: | H2O |
|---|---|
| Nucleus: | 13C |
| Frequency: | 400 MHz |
Documentation
| Document Description | Download | File Size |
|---|---|---|
| Peak List (TXT) | Download file | 1.24 KB |
| Peak Assignments (TXT) | Download file | 857 Bytes |
| Spectra Image with Peak Assignments | Not Available | Not Available |
| Raw Spectrum Image | Not Available | Not Available |
| nmrML File (NMRML) | Download file | 560 KB |
| JCAMP-DX File (JDX) | Download file | 152 KB |
| Raw Free Induction Decay file for spectral processing | Not Available | Not Available |
| Validation Report | Not Available | Not Available |
References
Not Available