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RDGXDBZPKSGZBM-UHFFFAOYSA-N
SpectraBase Compound ID LWhd7gcJxFy
InChI InChI=1S/C17H14N4S/c1-11-15-12(2)21-17(14(8-18)16(15)20-10-19-11)22-9-13-6-4-3-5-7-13/h3-7,10H,9H2,1-2H3
InChIKey RDGXDBZPKSGZBM-UHFFFAOYSA-N
Mol Weight 306.39 g/mol
Molecular Formula C17H14N4S
Exact Mass 306.093918 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8lmd2qnx6uX
Name RDGXDBZPKSGZBM-UHFFFAOYSA-N
Compound Number II-2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C17H14N4S
InChI InChI=1S/C17H14N4S/c1-11-15-12(2)21-17(14(8-18)16(15)20-10-19-11)22-9-13-6-4-3-5-7-13/h3-7,10H,9H2,1-2H3
InChIKey RDGXDBZPKSGZBM-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 306.385 g/mol
Solvent CDCl3
Source File Reference UWLU82291