Spectrum Details
NP-MRD ID:NP0233372
Compound name:1-(3-{1-[4-(acetyloxy)-9a,11a-dimethyl-7-oxo-1h,2h,3h,3ah,3bh,4h,5h,9bh,10h,11h-cyclopenta[a]phenanthren-1-yl]ethyl}-5,6,6-trimethyl-2,7,8-trioxabicyclo[3.2.1]octan-1-yl)-2-(methylsulfanyl)-2-oxoethyl acetate
Spectrum type:1H NMR Spectrum (1D, 400 MHz, H2O, predicted)
Spectrum View
Spectra Viewer Instructions...

Spectra Viewer Controls

ActionCommand
Zoom In/Out X AxisScroll wheel
Zoom In/Out Y AxisAlt/Option Key + Scroll wheel
Zoom In on AreaAlt/Option Key + Click and Drag around area
Zoom Out CompletelyAlt/Option Key + Click once anywhere on viewer
Move AroundClick and Drag

Zoombox Controls (box in upper left corner)

ActionCommand
Move AroundClick and Drag grey selection box
Zoom In on AreaClick on unselected region and drag around new selection
Zoom Out CompletelyClick once anywhere in unselected region
Alter Zoomed AreaClick and Drag on sides of grey selection box

Troubleshooting

If the viewer is not showing any spectra or is slow, try updating to the latest version of your browser. We have found that Google Chrome is the fastest.



?JSV
Multiplets 
7.41
6.15
6.08
4.88
4.88
4.52
2.52
2.43
2.40
2.27
2.11
2.05
2.04
2.02
1.77
1.62
1.62
1.61
1.58
1.50
1.49
1.40
1.20
1.05
0.68
Peak Assignment Table
Row No.Cluster MidpointNo. PeaksCoupling TypeNo. H'sAtom No.Peak Centers (ppm)
17.412d1
77
7.407.43
26.152d1
78
6.136.16
36.081s1
79
6.08
44.888ddd1
54
4.844.854.874.874.894.894.914.92
54.886ddd1
82
4.874.874.884.884.894.89
64.521s1
50
4.52
72.524dd2
80
81
2.522.522.522.52
82.431s3
47
48
49
2.43
92.408ddd1
65
2.372.382.392.402.402.412.422.43
102.278dd2
86
87
2.252.262.282.292.232.262.282.31
112.1116m1
55
2.072.082.092.092.102.102.102.112.122.122.122.122.132.132.142.15
122.051s6
91
92
93
94
95
96
2.05
132.041s3
51
52
53
2.04
142.021s3
83
84
85
2.02
151.7722ddd2
69
70
1.741.741.751.771.771.771.771.791.801.721.731.751.761.771.771.771.771.791.801.801.811.82
161.6272m2
60
61
1.541.551.551.561.571.571.571.581.581.591.591.591.601.601.601.601.611.611.611.611.621.631.631.631.641.641.641.641.651.651.651.661.661.671.671.671.681.681.681.691.701.711.551.561.571.571.571.571.581.581.591.601.601.601.611.611.621.621.621.631.631.631.631.641.651.651.661.661.671.681.681.68
171.6221ddd1
66
1.571.571.571.581.591.601.601.611.621.621.621.621.621.621.631.641.651.651.661.671.70
181.6131ddd1
64
1.551.561.571.571.581.581.591.591.601.601.601.601.601.601.611.621.621.621.621.631.631.631.631.641.641.651.651.661.661.671.67
191.5851ddd1
59
1.471.501.501.511.511.521.521.531.541.541.541.541.551.551.551.561.561.561.561.571.571.571.571.581.581.581.591.591.591.591.591.601.601.601.611.611.611.611.611.611.621.621.621.621.631.631.631.641.641.641.65
201.5025m2
67
68
1.441.461.481.491.491.491.511.511.521.541.541.551.441.461.461.471.471.491.511.511.531.541.541.541.56
211.4989m2
62
63
1.391.421.421.421.421.431.451.451.461.461.471.481.481.481.481.491.491.491.501.501.511.511.521.521.521.531.531.541.541.551.551.551.561.571.581.581.581.591.391.391.401.401.411.421.421.421.431.431.441.441.451.451.461.461.461.461.471.471.471.471.481.481.481.491.491.491.491.501.501.501.511.521.521.531.531.531.541.551.551.551.561.561.571.571.571.591.591.601.60
221.401s3
88
89
90
1.40
231.201s3
74
75
76
1.20
241.054q3
56
57
58
1.061.041.041.06
250.681s3
71
72
73
0.68
Experimental Conditions
Solvent:H2O
Nucleus:1H
Frequency:400 MHz
Documentation
Document DescriptionDownloadFile Size
Peak List (TXT)Download file21.2 KB
Peak Assignments (TXT)Download file1.48 KB
Spectra Image with Peak AssignmentsNot AvailableNot Available
Raw Spectrum ImageNot AvailableNot Available
nmrML File (NMRML)Download file594 KB
JCAMP-DX File (JDX)Download file182 KB
Raw Free Induction Decay file for spectral processingNot AvailableNot Available
Validation ReportNot AvailableNot Available
References
Not Available