Spectrum Details
YMDB ID:YMDB00717
Compound name:itaconyl-CoA
Spectrum type:13C NMR Spectrum
Spectrum View
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C53C30C29C28O54S27C26C25N24C23O56C22C21N20C19O52C18O44C17C43C42C16O15P14O47O46O13P12O49O48O38C37C10O11C1N2C6N5C4C33N45N34C35N36C3C8O9C7O39P40O41O51O50C31O32O55
Multiplets 196.54174.90171.80168.70155.69152.49149.46141.27135.29124.66119.6588.4877.6576.3673.3172.8470.9664.6939.5639.5036.4035.2830.5029.3021.28
No.CenterPeaksTypeC'sAtomsPeak Centers
1196.541s1
28
196.54
2174.901s1
19
174.90
3171.801s1
31
171.80
4168.701s1
23
168.70
5155.691s1
33
155.69
6152.491s1
35
152.49
7149.461s1
3
149.46
8141.271s1
6
141.27
9135.291s1
30
135.29
10124.661s1
53
124.66
11119.651s1
4
119.65
1288.481s1
1
88.48
1377.651s1
10
77.65
1476.361s1
18
76.36
1573.311s1
8
73.31
1672.841s1
7
72.84
1770.961s1
16
70.96
1864.691s1
37
64.69
1939.561s1
17
39.56
2039.501s1
25
39.50
2136.401s1
21
36.40
2235.281s1
22
35.28
2330.501s1
29
30.50
2429.301s1
26
29.30
2521.281s2
43
42
21.28

Experimental Conditions
Solvent:H2O
Nucleus:13C
Frequency:700
Documentation
Document DescriptionDownload
Peak ListDownload file
Peak AssignmentsDownload file
nmrML FileDownload file
JCAMP-DX fileDownload file
References
Not Available