1H NMR Spectrum (1D, 300 MHz, H2O, predicted) (NP0174148)
Spectrum Details
| NP-MRD ID: | NP0174148 |
|---|---|
| Compound name: | 6-[(1s,2s)-3-oxo-2-pentylcyclopentyl]hexanoic acid |
| Spectrum type: | 1H NMR Spectrum (1D, 300 MHz, H2O, predicted) |
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| Peak Assignment Table | |||||||
|---|---|---|---|---|---|---|---|
| Row No. | Cluster Midpoint | No. Peaks | Coupling Type | No. H's | Atom No. | Peak Centers (ppm) | |
| 1 | 2.80 | 6 | td | 1 | 31 | 2.782.782.802.802.822.83 | |
| 2 | 2.30 | 3 | t | 2 | 45 46 | 2.282.302.32 | |
| 3 | 2.12 | 14 | dd | 1 | 32 | 2.032.072.092.092.092.112.132.132.132.132.152.172.172.24 | |
| 4 | 2.12 | 14 | ddd | 1 | 33 | 2.032.052.072.092.092.112.132.132.132.152.162.172.172.22 | |
| 5 | 2.10 | 14 | m | 1 | 36 | 2.072.072.082.082.092.092.102.102.112.112.122.122.132.13 | |
| 6 | 1.58 | 25 | td | 2 | 29 30 | 1.551.611.501.521.521.541.551.551.551.571.581.581.581.591.591.601.601.601.611.611.611.621.621.641.64 | |
| 7 | 1.58 | 19 | m | 1 | 35 | 1.471.511.511.521.521.531.551.561.571.581.581.601.611.631.641.641.651.651.69 | |
| 8 | 1.58 | 13 | ddd | 1 | 34 | 1.481.511.521.551.561.571.571.581.601.611.641.651.68 | |
| 9 | 1.54 | 22 | tt | 2 | 43 44 | 1.471.481.481.491.501.521.541.601.611.491.501.511.521.521.541.541.561.561.581.581.601.61 | |
| 10 | 1.41 | 54 | td | 2 | 37 38 | 1.331.341.361.371.371.371.381.381.381.381.391.411.411.421.421.431.441.441.451.451.461.481.491.311.331.351.361.361.371.371.371.381.381.381.391.391.401.401.411.411.421.421.421.431.431.441.441.451.451.461.461.471.481.49 | |
| 11 | 1.36 | 53 | m | 2 | 41 42 | 1.291.301.321.331.331.341.341.351.351.351.361.361.371.381.381.391.391.411.431.441.281.291.291.301.311.321.321.321.331.331.331.341.341.351.351.351.351.361.361.371.371.371.381.381.391.391.401.401.401.411.411.421.44 | |
| 12 | 1.35 | 61 | m | 2 | 39 40 | 1.281.281.291.301.311.321.321.331.331.331.341.341.341.351.361.371.371.371.381.381.381.391.391.391.401.411.421.421.431.281.281.281.291.301.311.311.321.321.321.331.331.331.341.341.341.351.361.361.371.371.381.381.381.391.391.391.401.401.401.411.42 | |
| 13 | 1.32 | 62 | m | 2 | 27 28 | 1.251.251.261.261.261.271.271.271.281.281.291.291.291.301.301.321.321.341.341.361.361.361.371.381.391.421.251.261.261.271.271.281.291.291.291.291.301.301.301.301.311.321.321.321.321.321.331.341.341.341.351.351.361.361.361.361.371.371.381.391.391.42 | |
| 14 | 1.29 | 61 | tt | 2 | 25 26 | 1.221.221.231.241.251.251.251.251.261.261.271.271.271.281.291.291.291.291.301.301.301.311.311.321.331.331.331.351.361.361.221.221.241.251.251.251.251.261.261.271.271.271.281.291.291.291.291.301.301.311.311.311.321.321.321.331.331.341.351.361.37 | |
| 15 | 1.28 | 62 | m | 2 | 23 24 | 1.201.221.221.231.241.241.251.251.261.271.271.291.291.291.301.301.301.311.311.311.321.331.341.341.201.221.221.221.231.241.241.251.251.251.251.261.261.271.271.281.281.291.291.291.291.301.301.301.301.311.311.311.311.321.321.331.331.331.341.341.341.36 | |
| 16 | 0.88 | 43 | t | 3 | 20 21 22 | 0.830.860.880.890.900.900.920.930.950.960.810.830.830.850.860.860.870.870.880.880.890.900.900.930.940.810.830.840.840.850.860.860.860.870.870.880.880.880.890.900.900.920.93 | |
Experimental Conditions
| Solvent: | H2O |
|---|---|
| Nucleus: | 1H |
| Frequency: | 300 MHz |
Documentation
| Document Description | Download | File Size |
|---|---|---|
| Peak List (TXT) | Download file | 32.8 KB |
| Peak Assignments (TXT) | Download file | 819 Bytes |
| Spectra Image with Peak Assignments | Not Available | Not Available |
| Raw Spectrum Image | Not Available | Not Available |
| nmrML File (NMRML) | Download file | 599 KB |
| JCAMP-DX File (JDX) | Download file | 194 KB |
| Raw Free Induction Decay file for spectral processing | Not Available | Not Available |
| Validation Report | Not Available | Not Available |
References
Not Available