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1-(3-TRIFLUROMETHYLPHENYL)-3-[(1R)-1-(6-FLUORO-1,3-BENZOTHIAZOL-2-YL)-ETHYL]-IMIDAZOLIDINE-2,4,5-TRIONE
SpectraBase Compound ID 1TVyajLXTZt
InChI InChI=1S/C19H11F4N3O3S/c1-9(15-24-13-6-5-11(20)8-14(13)30-15)25-16(27)17(28)26(18(25)29)12-4-2-3-10(7-12)19(21,22)23/h2-9H,1H3/t9-/m1/s1
InChIKey CEYDROQDUOZWCJ-SECBINFHSA-N
Mol Weight 437.37 g/mol
Molecular Formula C19H11F4N3O3S
Exact Mass 437.045725 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 82UXWMRr0qX
Name 1-(3-TRIFLUROMETHYLPHENYL)-3-[(1R)-1-(6-FLUORO-1,3-BENZOTHIAZOL-2-YL)-ETHYL]-IMIDAZOLIDINE-2,4,5-TRIONE
Compound Number 3B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C19H11F4N3O3S
InChI InChI=1S/C19H11F4N3O3S/c1-9(15-24-13-6-5-11(20)8-14(13)30-15)25-16(27)17(28)26(18(25)29)12-4-2-3-10(7-12)19(21,22)23/h2-9H,1H3/t9-/m1/s1
InChIKey CEYDROQDUOZWCJ-SECBINFHSA-N
Literature Reference Author V.PEJCHAL,S.STEPANKOVA,Z.PADELKOVA,A.IMRAMOVSKY,J.JAMPILEK
Literature Reference Citation MOLECULES,16,7565(2011)
Literature Reference DOI 10.3390/molecules16097565
Molecular Weight 437.368 g/mol
Sample ID 161
Solvent DMSO-D6