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N-METHYL-N-[6-FLUORO-7-(4-METHYL-1-PIPERAZINYL)-3-METHYL-2-QUINOXALOYL]-2-AMINO-ETHANOL-1,4-DIOXIDE;ISOMER-#1
SpectraBase Compound ID YBlRQQOUzy
InChI InChI=1S/C18H24FN5O4/c1-12-17(18(26)21(3)8-9-25)24(28)16-11-14(13(19)10-15(16)23(12)27)22-6-4-20(2)5-7-22/h10-11,25H,4-9H2,1-3H3
InChIKey CGQGUROVUFIWIJ-UHFFFAOYSA-N
Mol Weight 393.42 g/mol
Molecular Formula C18H24FN5O4
Exact Mass 393.181232 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 814nkGbuM4F
Name N-METHYL-N-[6-FLUORO-7-(4-METHYL-1-PIPERAZINYL)-3-METHYL-2-QUINOXALOYL]-2-AMINO-ETHANOL-1,4-DIOXIDE;ISOMER-#1
Compound Number 12B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C18H24FN5O4
InChI InChI=1S/C18H24FN5O4/c1-12-17(18(26)21(3)8-9-25)24(28)16-11-14(13(19)10-15(16)23(12)27)22-6-4-20(2)5-7-22/h10-11,25H,4-9H2,1-3H3
InChIKey CGQGUROVUFIWIJ-UHFFFAOYSA-N
Literature Reference Author M.M.EL-ABADELAH,M.Z.NAZER,N.S.EL-ABADLA,H.MEIER
Literature Reference Citation HETEROCYCLES,41,2203(1995)
Literature Reference DOI 10.3987/COM-95-7128
Molecular Weight 393.418 g/mol
Solvent CDCl3
Source File Reference UWCP7756