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5-(2-CHLOROPHENYL)-4,7-DIOXO-2-THIOXO-1,2,3,4,5,6,7,8-OCTAHYDROPYRIDO-[2,3-D]-PYRIMIDINE
SpectraBase Compound ID J31UeDq2nKT
InChI InChI=1S/C13H10ClN3O2S/c14-8-4-2-1-3-6(8)7-5-9(18)15-11-10(7)12(19)17-13(20)16-11/h1-4,7H,5H2,(H3,15,16,17,18,19,20)
InChIKey ZJNYXTVRBOXRQJ-UHFFFAOYSA-N
Mol Weight 307.76 g/mol
Molecular Formula C13H10ClN3O2S
Exact Mass 307.018225 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 595iTmo9c99
Name 5-(2-CHLOROPHENYL)-4,7-DIOXO-2-THIOXO-1,2,3,4,5,6,7,8-OCTAHYDROPYRIDO-[2,3-D]-PYRIMIDINE
Compound Number 6C
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C13H10ClN3O2S
InChI InChI=1S/C13H10ClN3O2S/c14-8-4-2-1-3-6(8)7-5-9(18)15-11-10(7)12(19)17-13(20)16-11/h1-4,7H,5H2,(H3,15,16,17,18,19,20)
InChIKey ZJNYXTVRBOXRQJ-UHFFFAOYSA-N
Literature Reference Author R.RODRIGUEZ,M.SUAREZ,E.OCHOA,A.MORALES,L.GONZALEZ,N.MARTIN,M .QUINTEIRO,C.SEOANE,
Literature Reference Citation J.HETCYCL.CHEM.,33,45(1996)
Literature Reference DOI 10.1002/jhet.5570330108
Molecular Weight 307.754 g/mol
Solvent DMSO-D6
Source File Reference UWCS20853