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4-METHYL-6-NITRO-4H-BENZO-[1,4]-THIAZIN-3-ONE
SpectraBase Compound ID 68s8pLJMhW1
InChI InChI=1S/C9H8N2O3S/c1-10-7-4-6(11(13)14)2-3-8(7)15-5-9(10)12/h2-4H,5H2,1H3
InChIKey VYRJRYCCBMLLIL-UHFFFAOYSA-N
Mol Weight 224.23 g/mol
Molecular Formula C9H8N2O3S
Exact Mass 224.025563 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Ko12Nrl3ewE
Name 4-METHYL-6-NITRO-4H-BENZO-[1,4]-THIAZIN-3-ONE
Compound Number 4
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C9H8N2O3S
InChI InChI=1S/C9H8N2O3S/c1-10-7-4-6(11(13)14)2-3-8(7)15-5-9(10)12/h2-4H,5H2,1H3
InChIKey VYRJRYCCBMLLIL-UHFFFAOYSA-N
Literature Reference Author A.M.A.DESOUZA,V.L.D.M.GUARDA,L.F.C.D.C.LEITE,J.M.B.FILHO,M.D .C.A.DELIMA
Literature Reference Citation QUIM.NOVA,29,1106(2006)
Literature Reference DOI 10.1590/s0100-40422006000500035
Molecular Weight 224.234 g/mol
Solvent DMSO-D6
Source File Reference UWBT12180