Spectrum Details
NP-MRD ID:NP0188923
Compound name:(1s,3br,4r,5ar,7r,9as,9br,11as)-1-[(2s,3s,5r)-5-[(1s)-2-ethoxy-1-hydroxy-2-methylpropyl]-2-methoxyoxolan-3-yl]-4-hydroxy-3b,6,6,9a,11a-pentamethyl-1h,2h,4h,5h,5ah,7h,8h,9h,9bh,10h,11h-cyclopenta[a]phenanthren-7-yl acetate
Spectrum type:1H NMR Spectrum (1D, 100 MHz, H2O, predicted)
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?JSV
Multiplets 
5.30
5.21
4.60
4.47
4.12
4.12
3.66
3.32
2.63
2.14
2.08
2.01
1.90
1.86
1.73
1.72
1.69
1.64
1.35
1.32
1.25
1.25
1.24
1.07
1.01
0.89
Peak Assignment Table
Row No.Cluster MidpointNo. PeaksCoupling TypeNo. H'sAtom No.Peak Centers (ppm)
15.307dd1
63
5.175.185.265.305.345.425.43
25.2125m1
97
4.904.954.965.005.025.065.085.125.165.165.195.205.205.215.245.255.265.275.305.345.415.435.475.485.54
34.6023ddd1
56
4.284.334.424.474.484.514.514.554.564.584.594.604.624.634.654.674.694.724.744.764.804.834.87
44.4717dd1
79
4.134.324.344.354.364.404.464.464.474.494.544.544.594.604.624.624.73
54.128dd1
92
3.994.004.084.124.124.164.244.26
64.122d1
54
4.094.14
73.666q2
46
47
3.563.763.563.633.693.76
83.321s3
98
99
100
3.32
92.6328ddd2
61
62
2.442.482.502.572.602.622.642.672.682.702.742.772.792.812.822.452.492.532.562.572.592.602.622.662.702.702.732.73
102.1416dd1
71
1.941.961.982.002.062.072.092.112.132.172.182.252.262.272.332.47
112.0825ddd2
67
68
1.911.931.971.992.032.042.092.102.112.122.182.202.242.311.851.941.971.992.042.092.112.122.162.182.24
122.011s3
80
81
82
2.01
131.9055ddd2
57
58
1.581.691.701.711.721.751.761.771.781.801.811.821.841.861.881.881.891.891.931.961.982.002.012.032.052.092.102.122.122.132.151.661.681.721.771.781.801.821.851.861.881.891.901.911.931.941.951.962.002.002.032.052.082.102.19
141.8612ddd2
90
91
1.691.741.821.861.911.962.081.781.821.861.901.94
151.7332m2
77
78
1.451.501.561.571.591.601.621.701.721.741.781.851.871.891.911.931.991.521.571.631.641.671.691.701.721.751.771.771.791.821.972.04
161.7239m1
59
1.501.511.511.531.561.561.581.591.601.611.621.631.641.641.651.661.661.681.691.701.711.721.731.751.761.771.781.791.811.831.831.851.861.881.901.911.941.952.06
171.6938m2
69
70
1.431.501.511.531.551.581.611.631.631.641.651.691.721.731.741.761.791.841.851.901.951.351.581.611.631.651.671.701.701.721.731.761.781.801.811.821.831.86
181.6436ddd1
60
1.331.461.471.481.491.521.521.531.561.571.571.581.591.601.611.621.621.631.641.661.671.681.681.691.691.701.721.721.731.751.771.791.821.841.911.95
191.351s6
48
49
50
51
52
53
1.35
201.3230ddd2
75
76
1.041.101.151.171.201.231.301.311.311.341.381.381.411.431.471.501.501.571.051.181.251.291.301.311.341.351.381.431.451.56
211.258dd1
89
1.121.161.241.251.261.261.351.38
221.251s3
94
95
96
1.25
231.245t3
43
44
45
1.241.241.171.241.31
241.071s6
83
84
85
86
87
88
1.07
251.012s3
64
65
66
1.011.01
260.891s3
72
73
74
0.89
Experimental Conditions
Solvent:H2O
Nucleus:1H
Frequency:100 MHz
Documentation
Document DescriptionDownloadFile Size
Peak List (TXT)Download file23.7 KB
Peak Assignments (TXT)Download file1.6 KB
Spectra Image with Peak AssignmentsNot AvailableNot Available
Raw Spectrum ImageNot AvailableNot Available
nmrML File (NMRML)Download file598 KB
JCAMP-DX File (JDX)Download file190 KB
Raw Free Induction Decay file for spectral processingNot AvailableNot Available
Validation ReportNot AvailableNot Available
References
Not Available