1H NMR Spectrum (1D, 300 MHz, H2O, predicted) (MMDBc0029868)
Spectrum Details
MiMe ID: | MMDBc0029868 |
---|---|
Compound name: | PA(16:0/18:1(9Z)) |
Spectrum type: | 1H NMR Spectrum (1D, 300 MHz, H2O, predicted) |
Spectrum View
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Assignment Table | |||||||
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Row No. | Cluster Midpoint | No. Peaks | Coupling Type | No. H's | Atom No. | Peak Centers (ppm) | |
1 | 5.34 | 16 | dt | 2 | 64 65 | 5.295.295.305.315.325.335.335.335.345.355.355.365.365.375.395.39 | |
2 | 5.13 | 10 | m | 1 | 80 | 5.095.105.115.125.125.145.145.155.165.17 | |
3 | 4.35 | 2 | d | 2 | 81 82 | 4.344.36 | |
4 | 4.16 | 4 | dd | 2 | 114 115 | 4.144.164.164.18 | |
5 | 2.32 | 3 | t | 2 | 83 84 | 2.302.322.34 | |
6 | 2.31 | 3 | t | 2 | 78 79 | 2.292.312.33 | |
7 | 2.02 | 23 | dt | 2 | 66 67 | 1.951.951.961.961.971.991.992.002.002.012.012.022.032.032.032.042.052.052.052.072.082.082.10 | |
8 | 2.02 | 23 | dt | 2 | 62 63 | 1.951.951.961.961.971.991.992.002.002.012.012.022.032.032.032.042.052.052.052.072.082.082.10 | |
9 | 1.55 | 17 | tt | 2 | 85 86 | 1.491.501.511.531.551.571.591.611.491.511.531.551.551.571.571.591.61 | |
10 | 1.43 | 20 | tt | 2 | 76 77 | 1.381.381.401.401.411.441.371.381.391.391.421.421.441.441.461.461.481.481.501.51 | |
11 | 1.31 | 41 | tt | 2 | 68 69 | 1.241.251.271.271.291.291.301.301.301.321.321.341.351.361.241.251.251.261.261.271.271.281.281.291.291.301.301.311.311.321.321.321.331.331.341.351.361.361.371.371.38 | |
12 | 1.30 | 41 | tt | 2 | 60 61 | 1.241.251.261.261.271.271.281.291.291.301.301.321.331.331.361.251.251.261.261.271.271.281.281.291.291.301.301.311.311.321.321.321.331.331.341.351.361.361.371.371.38 | |
13 | 1.29 | 61 | m | 2 | 58 59 | 1.211.221.231.241.251.251.251.261.261.271.271.281.281.281.291.291.301.311.321.321.331.331.331.341.341.351.361.211.231.241.251.251.261.261.261.271.271.271.281.281.281.291.291.291.301.301.311.311.321.321.331.331.331.341.341.341.351.351.361.361.37 | |
14 | 1.28 | 56 | m | 2 | 70 71 | 1.191.201.211.211.221.221.241.241.251.261.261.271.271.271.291.291.291.301.301.321.341.351.201.211.231.231.241.241.241.251.261.261.271.271.271.281.281.291.291.291.301.301.311.311.321.321.331.331.331.341.341.351.351.361.361.37 | |
15 | 1.28 | 69 | m | 2 | 56 57 | 1.191.211.211.221.221.231.241.241.251.251.261.271.281.281.281.291.301.301.301.311.311.321.321.321.331.341.351.361.361.191.201.211.211.221.221.221.231.231.231.241.241.241.251.251.261.261.271.271.271.281.281.281.281.291.291.301.301.301.311.311.311.321.321.321.321.331.341.351.36 | |
16 | 1.27 | 63 | m | 2 | 50 51 | 1.191.211.231.231.241.241.241.251.251.251.261.261.271.271.281.281.281.281.291.291.291.301.301.301.311.321.331.191.211.211.211.231.231.241.241.241.251.251.251.261.261.261.271.271.271.281.281.281.281.291.291.291.301.301.301.311.311.321.321.331.331.331.35 | |
17 | 1.27 | 63 | m | 2 | 72 73 | 1.221.231.241.241.241.251.261.271.271.271.281.281.281.291.291.301.311.311.321.321.321.331.331.341.191.191.191.201.211.211.221.221.221.221.231.241.241.241.251.251.261.261.261.271.271.271.271.281.281.281.291.291.301.301.311.311.311.321.321.321.321.331.33 | |
18 | 1.27 | 63 | m | 2 | 109 110 | 1.191.211.231.231.241.241.241.251.251.251.261.261.271.271.271.271.281.281.281.281.291.291.291.301.301.311.321.331.191.211.211.211.231.231.231.241.241.241.251.251.251.261.261.271.271.281.281.281.281.291.291.291.301.301.301.311.311.321.321.331.331.331.35 | |
19 | 1.27 | 51 | m | 2 | 54 55 | 1.201.201.221.231.231.241.241.251.251.261.271.271.281.281.281.291.301.311.311.321.331.331.331.201.201.201.211.221.231.231.241.241.251.251.251.261.261.271.271.271.281.281.281.291.291.301.301.311.311.321.32 | |
20 | 1.26 | 56 | tt | 2 | 107 108 | 1.201.211.211.221.231.231.241.241.241.251.251.261.271.271.281.281.291.291.291.301.301.311.331.201.211.211.221.231.231.231.241.241.241.251.251.251.261.261.271.271.271.281.281.281.291.291.291.301.301.301.311.311.321.331.331.33 | |
21 | 1.26 | 62 | m | 2 | 74 75 | 1.181.191.201.201.211.211.211.221.221.231.231.241.251.251.251.261.261.261.271.271.281.281.281.281.291.291.301.311.201.211.211.221.221.231.231.231.241.251.251.251.261.261.271.271.271.281.281.281.281.291.291.301.301.301.311.321.321.331.331.331.351.37 | |
22 | 1.26 | 56 | tt | 2 | 52 53 | 1.201.211.211.221.221.231.231.241.241.241.241.251.251.261.271.271.271.281.281.281.291.291.301.311.331.201.211.211.221.221.231.231.231.241.241.241.251.251.261.261.271.271.271.281.281.281.291.291.301.301.301.311.321.331.331.33 | |
23 | 1.26 | 102 | m | 4 | 87 88 89 90 | 1.171.171.191.191.201.211.211.221.221.231.231.231.241.241.251.251.251.261.261.261.261.261.281.291.291.291.301.311.181.191.201.211.211.221.221.231.231.231.241.251.251.261.261.261.281.281.291.301.311.311.311.321.331.331.231.231.231.241.251.251.251.261.261.261.271.271.281.281.291.301.311.311.311.321.331.341.211.221.221.231.231.241.241.251.251.251.261.261.261.271.281.281.281.281.291.301.311.311.321.331.331.34 | |
24 | 1.26 | 65 | m | 2 | 105 106 | 1.181.191.201.201.211.211.221.221.221.231.231.231.241.241.251.251.251.261.271.271.271.271.281.281.281.281.291.291.291.301.301.311.311.321.331.331.201.201.211.211.211.221.221.231.231.241.241.251.251.261.261.271.271.271.281.281.281.291.301.301.301.311.311.321.32 | |
25 | 1.26 | 225 | m | 10 | 93 94 95 96 97 98 99 100 101 102 | 1.191.201.201.211.211.221.231.231.231.241.251.251.271.281.291.291.311.311.321.321.201.211.211.221.231.231.231.241.241.251.251.261.261.271.281.291.291.301.301.311.321.201.211.231.241.241.251.271.291.311.311.321.211.221.221.231.231.241.241.251.251.251.271.281.291.291.291.311.321.321.201.201.211.221.231.231.231.241.241.251.251.261.261.271.271.281.281.281.291.291.291.311.311.321.321.211.231.231.231.241.241.241.251.251.251.261.261.271.281.291.291.311.211.221.221.231.241.251.261.271.271.281.291.291.301.311.311.311.321.321.201.201.201.211.221.221.231.231.241.241.241.251.251.251.251.251.271.271.271.271.281.281.291.291.291.301.301.301.311.321.321.181.181.181.181.191.201.201.201.201.211.211.211.221.221.231.231.231.241.241.241.251.251.251.271.271.281.291.291.291.301.321.181.191.191.211.211.211.221.221.221.231.231.231.241.251.251.251.261.261.261.271.271.271.281.281.281.291.291.301.301.311.321.321.32 | |
26 | 1.26 | 60 | m | 2 | 103 104 | 1.191.191.201.211.211.221.221.231.231.241.241.241.251.251.261.261.271.271.281.281.291.291.301.301.311.311.321.321.191.191.191.201.211.221.221.221.231.231.241.241.241.251.251.261.261.261.271.271.271.281.281.281.281.291.291.301.301.301.311.32 | |
27 | 1.25 | 61 | m | 2 | 91 92 | 1.201.211.221.231.231.241.241.251.251.261.261.261.271.281.281.291.291.301.301.301.311.311.321.321.331.171.171.171.181.191.191.201.201.211.221.221.231.231.231.241.241.241.251.251.251.261.261.261.261.271.271.281.281.281.281.291.291.301.301.301.32 | |
28 | 0.88 | 40 | t | 3 | 111 112 113 | 0.850.860.860.880.880.890.900.900.900.900.830.850.860.860.880.890.900.930.940.810.830.840.840.860.860.860.870.870.870.880.880.880.890.900.900.900.920.920.930.95 | |
29 | 0.88 | 40 | t | 3 | 47 48 49 | 0.850.860.860.880.880.890.900.900.900.900.830.850.860.860.880.890.900.930.940.810.830.840.840.860.860.860.870.870.870.880.880.880.890.900.900.900.920.920.930.95 |
Experimental Conditions
Solvent: | H2O |
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Nucleus: | 1H |
Frequency: | 300 MHz |
Documentation
Document Description | Download | File Size |
---|---|---|
Peak List (TXT) | Download file | 93.1 KB |
Peak Assignments (TXT) | Download file | 1.97 KB |
Spectra Image with Peak Assignments | Not Available | Not Available |
Raw Spectrum Image | Not Available | Not Available |
nmrML File (NMRML) | Download file | 680 KB |
JCAMP-DX File (JDX) | Download file | 266 KB |
Raw Free Induction Decay file for spectral processing | Not Available | Not Available |
Validation Report | Not Available | Not Available |
References
Not Available