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Details
This molecule without stereoconfiguration:
This molecule with other stereoconfigurations:
User input (2D)
General
NMReDATA_chemie koeln_Classics in Spectroscopy/Deuteriumoxide (D2O)
Spectral Data
Additional Data
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Type: 13C
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Atom
Mult.(coupling const.)
Prediction
Shift
Prediction 0
hose_lotusv7
1
S
169.9
172.9
2
D
137.0
140.0
3
S
129.6
132.5
4
D
70.9
73.8
5
D
65.6
69.3
6
D
66.3
68.5
7
T
30.2
33.1
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Spectral Data
Additional Data
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13C Spectrum
70137085 Rating: 10
Type
13C
Prediction conditions
Program
HOSE code using nmrshiftdb2 data
Literature
Additional comments
SMILES_ID: Q105136690_30803; multplicities generated from proton count
Additional information
Spectrum categories
hose_lotusv7
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