13C NMR Spectrum (1D, 700 MHz, D2O, predicted) (HMDB0013062)
Spectrum Details
| HMDB ID: | HMDB0013062 |
|---|---|
| Compound name: | S-(PGA2)-glutathione |
| Spectrum type: | 13C NMR Spectrum (1D, 700 MHz, D2O, predicted) |
Spectrum View
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| Assignment Table | |||||||
|---|---|---|---|---|---|---|---|
| Row No. | Cluster Midpoint | No. Peaks | Coupling Type | No. C's | Atom No. | Peak Centers (ppm) | |
| 1 | 176.60 | 1 | s | 1 | 42 | 176.60 | |
| 2 | 175.83 | 1 | s | 1 | 16 | 175.83 | |
| 3 | 174.80 | 1 | s | 1 | 22 | 174.80 | |
| 4 | 172.40 | 1 | s | 1 | 29 | 172.40 | |
| 5 | 171.18 | 1 | s | 1 | 25 | 171.18 | |
| 6 | 136.39 | 1 | s | 1 | 9 | 136.39 | |
| 7 | 135.18 | 1 | s | 1 | 8 | 135.18 | |
| 8 | 128.92 | 1 | s | 1 | 37 | 128.92 | |
| 9 | 128.01 | 1 | s | 1 | 38 | 128.01 | |
| 10 | 72.73 | 1 | s | 1 | 6 | 72.73 | |
| 11 | 55.40 | 1 | s | 1 | 20 | 55.40 | |
| 12 | 52.70 | 1 | s | 1 | 14 | 52.70 | |
| 13 | 48.88 | 1 | s | 1 | 35 | 48.88 | |
| 14 | 47.47 | 1 | s | 1 | 11 | 47.47 | |
| 15 | 43.85 | 1 | s | 1 | 32 | 43.85 | |
| 16 | 41.87 | 1 | s | 1 | 28 | 41.87 | |
| 17 | 40.40 | 1 | s | 1 | 10 | 40.40 | |
| 18 | 36.97 | 1 | s | 1 | 5 | 36.97 | |
| 19 | 34.19 | 1 | s | 1 | 13 | 34.19 | |
| 20 | 33.20 | 1 | s | 1 | 41 | 33.20 | |
| 21 | 31.93 | 1 | s | 1 | 18 | 31.93 | |
| 22 | 31.53 | 1 | s | 1 | 3 | 31.53 | |
| 23 | 31.11 | 1 | s | 1 | 36 | 31.11 | |
| 24 | 27.40 | 1 | s | 1 | 19 | 27.40 | |
| 25 | 26.30 | 1 | s | 1 | 39 | 26.30 | |
| 26 | 25.03 | 1 | s | 1 | 4 | 25.03 | |
| 27 | 24.50 | 1 | s | 1 | 40 | 24.50 | |
| 28 | 22.47 | 1 | s | 1 | 2 | 22.47 | |
| 29 | 14.03 | 1 | s | 1 | 1 | 14.03 | |
Experimental Conditions
| Solvent: | D2O |
|---|---|
| Nucleus: | 13C |
| Frequency: | 700 MHz |
Documentation
| Document Description | Download | File Size |
|---|---|---|
| Peak List (TXT) | Download file | 1.33 KB |
| Peak Assignments (TXT) | Download file | 1.4 KB |
| Spectra Image with Peak Assignments | Not Available | Not Available |
| Raw Spectrum Image | Not Available | Not Available |
| nmrML File (NMRML) | Download file | 565 KB |
| JCAMP-DX File (JDX) | Download file | 83.8 KB |
| Raw Free Induction Decay file for spectral processing | Not Available | Not Available |
| Validation Report | Not Available | Not Available |
References
Not Available