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ZSXJQFYVZQDGHC-RIYZIHGNSA-N
SpectraBase Compound ID JjM3IL8mzcF
InChI InChI=1S/C12H9ClN4O3/c13-12-11(2-1-7-16(12)18)15-14-8-9-3-5-10(6-4-9)17(19)20/h1-8,15H/b14-8+
InChIKey ZSXJQFYVZQDGHC-RIYZIHGNSA-N
Mol Weight 292.68 g/mol
Molecular Formula C12H9ClN4O3
Exact Mass 292.036318 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LDJwXW660qG
Name ZSXJQFYVZQDGHC-RIYZIHGNSA-N
Compound Number 4H
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H9ClN4O3
InChI InChI=1S/C12H9ClN4O3/c13-12-11(2-1-7-16(12)18)15-14-8-9-3-5-10(6-4-9)17(19)20/h1-8,15H/b14-8+
InChIKey ZSXJQFYVZQDGHC-RIYZIHGNSA-N
Literature Reference Author S.ANDREAE,E.SCHMITZ
Literature Reference Citation HETEROCYCLES,37,379(1994)
Literature Reference DOI 10.3987/COM-93-S18
Molecular Weight 292.681 g/mol
Solvent DMSO-D6
Source File Reference UWCP4918