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3,6-DIMETHYL-1-PHENYL-PYRAZOLO-[3,4-D]-[1,3]-THIAZIN-4-ONE
SpectraBase Compound ID 56cmgVUBP5R
InChI InChI=1S/C13H11N3OS/c1-8-11-12(14-9(2)18-13(11)17)16(15-8)10-6-4-3-5-7-10/h3-7H,1-2H3
InChIKey BFNISDJLXIOEPW-UHFFFAOYSA-N
Mol Weight 257.31 g/mol
Molecular Formula C13H11N3OS
Exact Mass 257.062283 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DdUFeCzDQRi
Name 3,6-DIMETHYL-1-PHENYL-PYRAZOLO-[3,4-D]-[1,3]-THIAZIN-4-ONE
Compound Number 3D
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C13H11N3OS
InChI InChI=1S/C13H11N3OS/c1-8-11-12(14-9(2)18-13(11)17)16(15-8)10-6-4-3-5-7-10/h3-7H,1-2H3
InChIKey BFNISDJLXIOEPW-UHFFFAOYSA-N
Literature Reference Author C.B.VICENTINI,A.C.VERONESE,S.GUCCIONE,M.GUARNERI,M.MANFRINI, P.GIORI
Literature Reference Citation HETEROCYCLES,36,2291(1993)
Literature Reference DOI 10.3987/COM-93-6421
Molecular Weight 257.310 g/mol
Solvent CDCl3
Source File Reference UWCP5907