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XKNNRRDUVLDLKG-XDJHFCHBSA-N

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XKNNRRDUVLDLKG-XDJHFCHBSA-N
SpectraBase Compound ID DZyO6OAvUed
InChI InChI=1S/C16H13IN4O/c1-11-15(19-18-13-9-7-12(17)8-10-13)16(22)21(20-11)14-5-3-2-4-6-14/h2-10,18H,1H3/b19-15+
InChIKey XKNNRRDUVLDLKG-XDJHFCHBSA-N
Mol Weight 404.21 g/mol
Molecular Formula C16H13IN4O
Exact Mass 404.013406 g/mol

15N Nuclear Magnetic Resonance (NMR) Chemical Shifts

15N Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DH6E6NhM91M
Name XKNNRRDUVLDLKG-XDJHFCHBSA-N
Compound Number 1H
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C16H13IN4O
InChI InChI=1S/C16H13IN4O/c1-11-15(19-18-13-9-7-12(17)8-10-13)16(22)21(20-11)14-5-3-2-4-6-14/h2-10,18H,1H3/b19-15+
InChIKey XKNNRRDUVLDLKG-XDJHFCHBSA-N
Literature Reference Author A.LYCKA,T.LIPTAJ,J.JIRMAN
Literature Reference Citation COLL.CZ.CH.COMM.,52,727(1987)
Literature Reference DOI 10.1135/cccc19870727
Solvent CDCl3;CR(ACAC)3=20G/L
Source File Reference UWED16598