1H NMR Spectrum (1D, 100 MHz, D2O, predicted) (NP0071677)

Spectrum Details
NP-MRD ID:NP0071677
Compound name:(-)-Pseudoprotodioscin
Spectrum type:1H NMR Spectrum (1D, 100 MHz, D2O, predicted)
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?JSV
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Multiplets❮ ❯
7.28
5.18
4.37
4.12
4.12
4.11
4.03
3.89
3.89
3.89
3.87
3.87
3.86
3.85
3.85
3.84
3.84
3.74
3.73
3.60
3.55
3.50
3.49
3.48
3.41
2.58
2.58
2.17
2.11
2.08
2.03
2.01
1.98
1.83
1.81
1.79
1.71
1.66
1.51
1.43
1.40
1.30
1.15
1.12
1.00
0.98
0.71
0.69
Peak Assignment Table
Row No.Cluster MidpointNo. PeaksCoupling TypeNo. H'sAtom No.Peak Centers (ppm)
17.283dd1
104
7.247.287.32
25.182d1
86
5.175.19
34.375dd1
95
4.334.334.344.414.43
44.1219dd2
123
125
4.004.024.064.084.094.104.114.114.134.154.154.164.184.214.264.074.094.174.18
54.122d1
121
4.114.13
64.1110dd1
93
3.984.034.074.074.084.114.134.164.214.25
74.0315dd1
133
3.843.863.903.943.943.983.984.054.074.074.104.144.144.194.25
83.897dd1
113
3.813.833.843.863.873.884.16
93.892d2
84
85
3.863.92
103.895quint1
128
3.823.823.893.894.01
113.8726ddd1
97
3.563.583.603.653.673.703.723.743.763.773.843.843.853.863.933.933.943.953.994.024.024.054.084.144.214.30
123.877dd1
127
3.723.793.813.883.893.974.05
133.8621dq1
129
3.633.653.653.663.723.783.793.813.843.843.853.883.893.913.913.963.974.034.044.094.10
143.852d1
119
3.823.89
153.854q1
108
3.783.833.873.92
163.8437m1
107
3.453.603.623.633.643.713.753.763.773.773.783.783.803.813.813.833.843.853.853.863.873.873.883.893.903.913.933.943.953.953.963.963.994.064.084.094.11
173.844q1
114
3.803.843.853.89
183.746dt2
110
111
3.723.733.723.733.783.78
193.7316m2
88
89
3.653.673.673.723.843.643.653.673.723.733.743.753.763.783.783.84
203.609dd1
137
3.443.463.563.573.613.643.673.703.74
213.5514dd1
91
3.383.393.433.453.463.513.523.543.593.603.613.693.703.80
223.5016dt1
87
3.363.383.423.433.463.463.473.503.513.513.523.543.553.593.603.67
233.498dq1
115
3.363.423.433.483.493.543.553.61
243.488td1
109
3.423.443.473.483.493.503.533.55
253.4112dd1
135
3.233.233.293.293.403.443.463.483.493.523.553.56
262.585t2
76
77
2.512.522.582.652.65
272.581s3
73
74
75
2.58
282.174dd2
105
106
2.122.212.132.21
292.1117ddd2
102
103
1.681.821.842.002.062.102.142.152.182.192.252.442.482.062.102.142.18
302.0821m1
80
1.681.761.801.871.921.931.982.032.042.072.092.102.162.162.212.222.272.282.322.342.46
312.0317ddd1
141
1.781.811.911.931.941.961.971.982.032.052.062.072.082.102.192.212.39
322.0139m1
147
1.711.731.741.751.791.811.831.841.851.861.881.891.911.931.941.951.971.981.981.992.002.022.032.052.072.082.102.142.152.162.172.182.202.212.252.282.302.312.34
331.9825ddt1
148
1.781.791.821.831.851.881.901.911.931.941.951.961.971.981.992.012.032.042.082.112.132.152.162.222.23
341.832d1
154
1.781.87
351.8126ddd1
100
1.541.581.591.611.671.681.691.711.731.761.781.791.821.821.841.881.891.891.901.921.931.962.002.032.042.07
361.7940ddd1
146
1.301.301.381.511.521.541.581.601.621.631.671.691.701.721.721.741.751.761.781.801.821.831.841.841.881.891.891.901.921.931.951.972.002.022.032.042.052.062.102.18
371.7116dtd1
79
1.311.441.511.621.681.681.691.741.751.751.801.811.861.871.871.93
381.6642ddd2
98
99
1.271.421.461.511.551.581.581.591.601.621.661.671.711.761.771.791.831.871.881.361.441.451.481.491.551.571.581.591.661.661.701.711.721.751.771.811.831.841.861.881.911.94
391.5148m1
101
1.011.071.121.151.201.221.231.251.301.311.331.341.361.371.391.401.411.421.431.441.451.481.491.491.511.521.541.581.581.601.611.641.661.681.691.701.711.721.741.761.771.801.811.811.821.841.871.88
401.4331m2
139
140
1.261.291.321.341.371.381.401.411.421.461.491.501.521.791.191.211.271.311.331.361.391.411.431.471.491.531.551.561.591.611.66
411.4016dtd1
78
0.981.261.321.321.331.381.391.391.441.451.451.501.511.521.581.68
421.3054ddd2
149
150
0.940.981.121.141.161.171.191.221.241.261.291.301.321.341.341.351.361.391.391.411.441.451.471.491.511.511.550.971.011.021.061.071.081.091.111.201.201.241.261.291.301.311.331.361.381.411.411.431.451.471.501.591.601.62
431.159m3
130
131
132
1.101.161.101.160.971.101.161.291.34
441.125quint3
116
117
118
1.101.101.161.101.16
451.006dt3
81
82
83
0.971.030.971.030.971.03
460.9820ddd1
142
0.770.780.840.880.900.910.920.930.960.991.001.021.041.051.061.071.111.111.171.19
470.711s3
151
152
153
0.71
480.693s3
143
144
145
0.690.690.69
Experimental Conditions
Solvent:D2O
Nucleus:1H
Frequency:100 MHz
Documentation
Document DescriptionDownloadFile Size
Peak List (TXT)Download file39.3 KB
Peak Assignments (TXT)Download file2.5 KB
Spectra Image with Peak AssignmentsNot AvailableNot Available
Raw Spectrum ImageNot AvailableNot Available
nmrML File (NMRML)Download file632 KB
JCAMP-DX File (JDX)Download file221 KB
Raw Free Induction Decay file for spectral processingNot AvailableNot Available
Validation ReportNot AvailableNot Available
References
Not Available