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QKIVRTVNVXJCNA-UHFFFAOYSA-N
SpectraBase Compound ID 6I7W8wnsQ7x
InChI InChI=1S/C18H18F3N3O4/c1-4-28-17(26)14-13(18(19,20)21)9-10(2)22-15(14)23-24-16(25)11-5-7-12(27-3)8-6-11/h5-9H,4H2,1-3H3,(H,22,23)(H,24,25)
InChIKey QKIVRTVNVXJCNA-UHFFFAOYSA-N
Mol Weight 397.35 g/mol
Molecular Formula C18H18F3N3O4
Exact Mass 397.124941 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID I2BSRZiKm7v
Name QKIVRTVNVXJCNA-UHFFFAOYSA-N
Compound Number 4I
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C18H18F3N3O4
InChI InChI=1S/C18H18F3N3O4/c1-4-28-17(26)14-13(18(19,20)21)9-10(2)22-15(14)23-24-16(25)11-5-7-12(27-3)8-6-11/h5-9H,4H2,1-3H3,(H,22,23)(H,24,25)
InChIKey QKIVRTVNVXJCNA-UHFFFAOYSA-N
Literature Reference Author M.T.COCCO,C.CONGIU,V.ONNIS,A.M.BERNARD,P.P.PIRAS
Literature Reference Citation J.HETCYCL.CHEM.,34,1283(1997)
Literature Reference DOI 10.1002/jhet.5570340432
Molecular Weight 397.354 g/mol
Solvent CDCl3
Source File Reference UWSW752