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Spectral Data   Additional Data   Download  
Molecule
10005600
Chemical name(s)1,2-Ethanediol; Ethylene glycol
Chemical formulaC2H6O2
Molecular weight62.0678
Number of double bond equivalents (DBEs)0.0
Number of all rings, size of smallest set of smallest rings0, 0
Canonical name(s)
CAS-Number 107-21-1
Additional information wikidata; NCI Database; ChEBI;
Links from Unichem: Nikkaji;Mcule;MolPort;SureChEMBL;rxnorm;ZINC;EPA (Environmental Protection Agency) CompTox Dashboard;clinicaltrials;PubChem Compounds;Probes And Drugs;clinicaltrials;FDA/USP Substance Registration Sys... (truncated)
Molecule keywords
DOI10.18716/nmrshiftdb2/10005600
13C Spectrum
60001558 Rating: 9 (9: 9: nmrshiftdb2 quality check: accept (admin))
Type13C
Measurement conditions
Temperature [K]Unreported
SolventUnreported
Field Strength [MHz]Unreported
Assignment MethodUnreported
Literature Stefan Berger; S. Braun; H.-O. Kalinowski: 13-C-NMR-Spektroskopie, New York: Thieme Verlag 1984.
Additional comments1041.MOL; Multiplicities generated automatically from H count
nmrshiftdb2 quality report Download
Additional information
Spectrum categories



Spectral Data   Additional Data   Download  
Type: 13C 75.03250122070312 Double click to get resizeable window!
Atom
Mult.(coupling const.)
Meas.
Shift
expt-0
dkfz spektren database
expt-1
Prediction 2
acd_lotusv7
Prediction 3
hose_lotusv7
1 T 62.637 67.363.463.6664.19
2 T 62.637 67.363.463.6664.19

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Spectral Data   Additional Data   Download  
Type: 13C 23 Double click to get resizeable window!
Atom
Mult.(coupling const.)
Meas.
Shift
expt-0
expt-1
Prediction 2
acd_lotusv7
Prediction 3
hose_lotusv7
1 T 67.3 62.63763.463.6664.19
2 T 67.3 62.63763.463.6664.19

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Spectral Data   Additional Data   Download  
Type: 13C Double click to get resizeable window!
Atom
Mult.(coupling const.)
Prediction
Shift
expt-0
dkfz spektren database
expt-1
expt-2
Prediction 3
hose_lotusv7
1 T 63.66 67.362.63763.464.19
2 T 63.66 67.362.63763.464.19

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Spectral Data   Additional Data   Download  
Type: 13C Double click to get resizeable window!
Atom
Mult.(coupling const.)
Prediction
Shift
expt-0
dkfz spektren database
expt-1
expt-2
Prediction 3
acd_lotusv7
1 T 64.19 67.362.63763.463.66
2 T 64.19 67.362.63763.463.66

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