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This molecule with other stereoconfigurations:

Spectral Data   Additional Data   Download  
Chemical name(s)AC1M4DZM
Chemical formulaC13H12NO2F
Molecular weight233.239
Number of double bond equivalents (DBEs)8.0
Number of all rings, size of smallest set of smallest rings1, 1
Canonical name(s)
Additional information
Links from Unichem: ZINC;eMolecules;SureChEMBL;PubChem ('Thomson Pharma' subset);PubChem Compounds
Molecule keywords
13C Spectrum
60003839 Rating: 9 (9: 9: nmrshiftdb2 quality check: accept/reliability: excellent (admin))
Measurement conditions
Temperature [K]298
SolventChloroform-D1 (CDCl3)
Field Strength [MHz]150.0
Assignment Method1D shifts
Literature Ute A. Hellmich; R. Luise Krauth-Siegel; Daniel Paszek; Till Opatz; Hermann Schindelin; A. Katharina Weickhmann; Thien Anh Le; Nicole Bader; Erika Diehl; Natalie Dirdjaja; Philipp Klein; Bernd Engels; Martha Brennich; Annika Wagner: Angewandte Chemie, in: Inhibitor-induzierte Dimerisierung einer essentiellen Oxidoreduktase aus afrikanischen Trypanosomen, vol. 2019, pp. ? - ? (DOI: 10.1002/ange.201810470) (URL: http://https://doi.org/10.1002/ange.201810470).
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Additional information
Spectrum categoriesocmainz inhouse-2

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