13C NMR Spectrum (1D, 101 MHz, D2O, predicted) (NP0001302)
Spectrum Details
| NP-MRD ID: | NP0001302 |
|---|---|
| Compound name: | 3a,6a,7b-Trihydroxy-5b-cholanoic acid |
| Spectrum type: | 13C NMR Spectrum (1D, 101 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 | 175.83 | 1 | s | 1 | 5 | 175.83 | |
| 2 | 74.33 | 1 | s | 2 | 26 28 | 74.33 | |
| 3 | 71.80 | 1 | s | 1 | 22 | 71.80 | |
| 4 | 57.20 | 1 | s | 1 | 8 | 57.20 | |
| 5 | 51.80 | 1 | s | 1 | 11 | 51.80 | |
| 6 | 48.50 | 1 | s | 1 | 25 | 48.50 | |
| 7 | 43.90 | 1 | s | 1 | 16 | 43.90 | |
| 8 | 40.80 | 1 | s | 1 | 15 | 40.80 | |
| 9 | 40.70 | 1 | s | 1 | 13 | 40.70 | |
| 10 | 38.52 | 1 | s | 1 | 12 | 38.52 | |
| 11 | 38.20 | 1 | s | 1 | 20 | 38.20 | |
| 12 | 36.90 | 1 | s | 1 | 18 | 36.90 | |
| 13 | 36.70 | 1 | s | 1 | 2 | 36.70 | |
| 14 | 33.00 | 1 | s | 1 | 24 | 33.00 | |
| 15 | 32.10 | 1 | s | 1 | 3 | 32.10 | |
| 16 | 31.60 | 1 | s | 1 | 4 | 31.60 | |
| 17 | 31.50 | 1 | s | 1 | 21 | 31.50 | |
| 18 | 29.40 | 1 | s | 1 | 9 | 29.40 | |
| 19 | 24.90 | 1 | s | 1 | 10 | 24.90 | |
| 20 | 22.40 | 1 | s | 1 | 14 | 22.40 | |
| 21 | 19.10 | 1 | s | 1 | 1 | 19.10 | |
| 22 | 13.70 | 1 | s | 1 | 19 | 13.70 | |
| 23 | 12.80 | 1 | s | 1 | 17 | 12.80 | |
Experimental Conditions
| Solvent: | D2O |
|---|---|
| Nucleus: | 13C |
| Frequency: | 400 MHz |
Documentation
| Document Description | Download | File Size |
|---|---|---|
| Peak List (TXT) | Download file | 1.09 KB |
| Peak Assignments (TXT) | Download file | 1.15 KB |
| Spectra Image with Peak Assignments | Not Available | Not Available |
| Raw Spectrum Image | Not Available | Not Available |
| nmrML File (NMRML) | Download file | 561 KB |
| JCAMP-DX File | Not Available | Not Available |
| Raw Free Induction Decay file for spectral processing | Not Available | Not Available |
| Validation Report | Not Available | Not Available |
References
Not Available