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MHTFKSMZKXQASO-UHFFFAOYSA-N
SpectraBase Compound ID Yx04IQLXLo
InChI InChI=1S/C16H11ClN4O/c1-9-14-10(2)21-16(13(7-18)15(14)20-8-19-9)22-12-5-3-11(17)4-6-12/h3-6,8H,1-2H3
InChIKey MHTFKSMZKXQASO-UHFFFAOYSA-N
Mol Weight 310.74 g/mol
Molecular Formula C16H11ClN4O
Exact Mass 310.062139 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HdGQsKn1Bb1
Name MHTFKSMZKXQASO-UHFFFAOYSA-N
Compound Number II-1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C16H11ClN4O
InChI InChI=1S/C16H11ClN4O/c1-9-14-10(2)21-16(13(7-18)15(14)20-8-19-9)22-12-5-3-11(17)4-6-12/h3-6,8H,1-2H3
InChIKey MHTFKSMZKXQASO-UHFFFAOYSA-N
Literature Reference Author G.XU,J.SONG,J.HE,Q.REN,W.MO,H.XU,S.SUN,H.HE,Y.CUI
Literature Reference Citation MAGN.RES.CHEM.,50,646(2012)
Literature Reference DOI 10.1002/mrc.3853
Molecular Weight 310.743 g/mol
Solvent CDCl3
Source File Reference UWLU82290