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PYRAZINE-[E]-CANTHIN-6-ONE

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PYRAZINE-[E]-CANTHIN-6-ONE
SpectraBase Compound ID 903PhZ6OScl
InChI InChI=1S/C16H8N4O/c21-16-14-12(18-7-8-19-14)13-15-10(5-6-17-13)9-3-1-2-4-11(9)20(15)16/h1-8H
InChIKey IBQHMWYATBDGQZ-UHFFFAOYSA-N
Mol Weight 272.27 g/mol
Molecular Formula C16H8N4O
Exact Mass 272.069811 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID i8jUnr4Rif
Name PYRAZINE-[E]-CANTHIN-6-ONE
Compound Number 28
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C16H8N4O
InChI InChI=1S/C16H8N4O/c21-16-14-12(18-7-8-19-14)13-15-10(5-6-17-13)9-3-1-2-4-11(9)20(15)16/h1-8H
InChIKey IBQHMWYATBDGQZ-UHFFFAOYSA-N
Literature Reference Author F.SORIANO-AGATON,D.LAGOUTTE,E.POUPON,F.ROBLOT,A.FOURNET,J.C. GANTIER,R.HOCQUEMILL
Literature Reference Citation J.NAT.PROD.,68,1581(2005)
Literature Reference DOI 10.1021/np050250z
Molecular Weight 272.266 g/mol
Solvent CDCl3
Source File Reference UWMZ13051