13C NMR Spectrum (1D, 126 MHz, H2O, predicted) (NP0213797)
Spectrum Details
| NP-MRD ID: | NP0213797 |
|---|---|
| Compound name: | (1r,3as,3bs,4s,7s,9ar,9bs,11ar)-1-[(2r,5r)-5-ethyl-6-methylhept-6-en-2-yl]-9a,11a-dimethyl-1h,2h,3h,3ah,3bh,4h,6h,7h,8h,9h,9bh,10h,11h-cyclopenta[a]phenanthrene-4,7-diol |
| Spectrum type: | 13C NMR Spectrum (1D, 126 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 | 147.94 | 1 | s | 1 | 2 | 147.94 | |
| 2 | 146.00 | 1 | s | 1 | 19 | 146.00 | |
| 3 | 123.90 | 1 | s | 1 | 18 | 123.90 | |
| 4 | 110.28 | 1 | s | 1 | 1 | 110.28 | |
| 5 | 71.20 | 1 | s | 1 | 21 | 71.20 | |
| 6 | 69.64 | 1 | s | 1 | 16 | 69.64 | |
| 7 | 56.93 | 1 | s | 1 | 11 | 56.93 | |
| 8 | 51.80 | 1 | s | 1 | 14 | 51.80 | |
| 9 | 50.54 | 1 | s | 1 | 27 | 50.54 | |
| 10 | 43.19 | 1 | s | 1 | 30 | 43.19 | |
| 11 | 41.80 | 1 | s | 1 | 20 | 41.80 | |
| 12 | 41.63 | 1 | s | 1 | 4 | 41.63 | |
| 13 | 40.98 | 1 | s | 1 | 29 | 40.98 | |
| 14 | 38.52 | 1 | s | 1 | 15 | 38.52 | |
| 15 | 37.23 | 1 | s | 1 | 24 | 37.23 | |
| 16 | 36.41 | 1 | s | 1 | 25 | 36.41 | |
| 17 | 35.35 | 1 | s | 1 | 9 | 35.35 | |
| 18 | 33.37 | 1 | s | 1 | 8 | 33.37 | |
| 19 | 32.23 | 1 | s | 1 | 23 | 32.23 | |
| 20 | 29.40 | 1 | s | 1 | 12 | 29.40 | |
| 21 | 28.16 | 1 | s | 1 | 7 | 28.16 | |
| 22 | 26.21 | 1 | s | 1 | 5 | 26.21 | |
| 23 | 24.90 | 1 | s | 1 | 13 | 24.90 | |
| 24 | 22.21 | 1 | s | 1 | 28 | 22.21 | |
| 25 | 21.23 | 1 | s | 1 | 3 | 21.23 | |
| 26 | 19.20 | 1 | s | 1 | 10 | 19.20 | |
| 27 | 18.71 | 1 | s | 1 | 26 | 18.71 | |
| 28 | 12.69 | 1 | s | 1 | 31 | 12.69 | |
| 29 | 11.63 | 1 | s | 1 | 6 | 11.63 | |
Experimental Conditions
| Solvent: | H2O |
|---|---|
| Nucleus: | 13C |
| Frequency: | 500 MHz |
Documentation
| Document Description | Download | File Size |
|---|---|---|
| Peak List (TXT) | Download file | 1.49 KB |
| Peak Assignments (TXT) | Download file | 1.33 KB |
| Spectra Image with Peak Assignments | Not Available | Not Available |
| Raw Spectrum Image | Not Available | Not Available |
| nmrML File (NMRML) | Download file | 563 KB |
| JCAMP-DX File (JDX) | Download file | 156 KB |
| Raw Free Induction Decay file for spectral processing | Not Available | Not Available |
| Validation Report | Not Available | Not Available |
References
Not Available