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VYTYOARPJASXFA-UHFFFAOYSA-N
SpectraBase Compound ID 2uBrJjjQ2t8
InChI InChI=1S/C20H16ClN3O5/c1-2-29-20(26)18-11-16(22-23(18)12-13-6-4-3-5-7-13)19(25)15-10-14(21)8-9-17(15)24(27)28/h3-11H,2,12H2,1H3
InChIKey VYTYOARPJASXFA-UHFFFAOYSA-N
Mol Weight 413.82 g/mol
Molecular Formula C20H16ClN3O5
Exact Mass 413.077848 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HeHOXOq7HfR
Name VYTYOARPJASXFA-UHFFFAOYSA-N
Compound Number 23
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H16ClN3O5
InChI InChI=1S/C20H16ClN3O5/c1-2-29-20(26)18-11-16(22-23(18)12-13-6-4-3-5-7-13)19(25)15-10-14(21)8-9-17(15)24(27)28/h3-11H,2,12H2,1H3
InChIKey VYTYOARPJASXFA-UHFFFAOYSA-N
Literature Reference Author L.C.LOPEZ-CARA,M.D.CARRION,M.E.CAMACHO,M.A.GALLO,A.ESPINOSA, D.CHOQUESILLO-LAZART
Literature Reference Citation MAGN.RES.CHEM.,46,878(2008)
Literature Reference DOI 10.1002/mrc.2256
Molecular Weight 413.817 g/mol
Solvent CDCl3
Source File Reference UWLU82618