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4-PHENYL-3,4,7,8-TETRAHYDRO-(2H)-PYRIMIDO-[3,2-B]-1,4-THIAZIN-3,8-DIONE
SpectraBase Compound ID 1fiopHwa43H
InChI InChI=1S/C12H9N3O2S/c16-9-6-18-10-11(13-7-14-12(10)17)15(9)8-4-2-1-3-5-8/h1-5,7H,6H2,(H,13,14,17)
InChIKey GPPLURKBOOMJMY-UHFFFAOYSA-N
Mol Weight 259.28 g/mol
Molecular Formula C12H9N3O2S
Exact Mass 259.041548 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID IO7nCdxU4bO
Name 4-PHENYL-3,4,7,8-TETRAHYDRO-(2H)-PYRIMIDO-[3,2-B]-1,4-THIAZIN-3,8-DIONE
Compound Number 18
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H9N3O2S
InChI InChI=1S/C12H9N3O2S/c16-9-6-18-10-11(13-7-14-12(10)17)15(9)8-4-2-1-3-5-8/h1-5,7H,6H2,(H,13,14,17)
InChIKey GPPLURKBOOMJMY-UHFFFAOYSA-N
Literature Reference Author K.GEWALD,U.HAIN,R.SCHINDLER,M.GRUNER
Literature Reference Citation MH.CHEM.,125,1129(1994)
Literature Reference DOI 10.1007/BF00811521
Molecular Weight 259.282 g/mol
Solvent DMSO-D6
Source File Reference UWPR1893