1H NMR Spectrum (1D, 500 MHz, D2O, predicted) (NP0044306)

Spectrum Details
NP-MRD ID:NP0044306
Compound name:3-Hydroxypropionyl-CoA
Spectrum type:1H NMR Spectrum (1D, 500 MHz, D2O, predicted)
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?JSV
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Multiplets❮ ❯
8.49
5.97
4.37
4.37
4.37
4.25
4.19
3.98
3.85
3.70
3.47
3.43
2.92
2.65
2.41
2.25
0.92
0.88
Peak Assignment Table
Row No.Cluster MidpointNo. PeaksCoupling TypeNo. H'sAtom No.Peak Centers (ppm)
18.491s2
68
71
8.49
25.975quint1
67
5.965.965.975.985.98
34.379td1
66
4.364.364.364.374.374.374.384.384.38
44.3714dd1
72
4.354.354.354.364.364.364.374.374.384.384.384.394.394.39
54.3715ddd1
74
4.354.364.364.364.364.374.374.374.374.374.374.384.384.384.39
64.2519ddd1
65
4.224.234.234.244.244.244.244.254.254.254.254.264.264.264.264.264.274.274.28
74.192d2
60
61
4.184.20
83.981s1
77
3.98
93.853t2
91
92
3.843.853.86
103.7020ddd1
64
3.673.683.683.693.693.693.693.703.703.703.703.713.713.713.713.713.713.723.723.73
113.473t2
85
86
3.463.473.48
123.435dt1
81
3.403.423.433.443.46
132.924t2
87
88
2.932.912.922.93
142.653t2
82
83
2.642.652.66
152.416dt1
80
2.382.402.412.422.422.44
162.253t2
89
90
2.242.252.26
170.921s3
54
55
56
0.92
180.881s3
57
58
59
0.88
Experimental Conditions
Solvent:D2O
Nucleus:1H
Frequency:500 MHz
Documentation
Document DescriptionDownloadFile Size
Peak List (TXT)Download file7.24 KB
Peak Assignments (TXT)Download file1.22 KB
Spectra Image with Peak AssignmentsNot AvailableNot Available
Raw Spectrum ImageNot AvailableNot Available
nmrML File (NMRML)Download file570 KB
JCAMP-DX File (JDX)Download file166 KB
Raw Free Induction Decay file for spectral processingNot AvailableNot Available
Validation ReportNot AvailableNot Available
References
Not Available