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4-[(4-METHYL-2-OXO-1,4-DIHYDRO-2H-3,1-BENZOTHIAZIN-4-YL)-METHYLENE]-2-OXO-1,3-DIHYDRO-2H-3,1-BENZOTHIAZINE
SpectraBase Compound ID 3dU4LIoaiZ5
InChI InChI=1S/C18H14N2O2S2/c1-18(12-7-3-5-9-14(12)20-17(22)24-18)10-15-11-6-2-4-8-13(11)19-16(21)23-15/h2-10H,1H3,(H,19,21)(H,20,22)/b15-10-
InChIKey YMNPHCUPLWJEHU-GDNBJRDFSA-N
Mol Weight 354.44 g/mol
Molecular Formula C18H14N2O2S2
Exact Mass 354.04967 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6SUG63K1ftM
Name 4-[(4-METHYL-2-OXO-1,4-DIHYDRO-2H-3,1-BENZOTHIAZIN-4-YL)-METHYLENE]-2-OXO-1,3-DIHYDRO-2H-3,1-BENZOTHIAZINE
Compound Number 5A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C18H14N2O2S2
InChI InChI=1S/C18H14N2O2S2/c1-18(12-7-3-5-9-14(12)20-17(22)24-18)10-15-11-6-2-4-8-13(11)19-16(21)23-15/h2-10H,1H3,(H,19,21)(H,20,22)/b15-10-
InChIKey YMNPHCUPLWJEHU-GDNBJRDFSA-N
Literature Reference Author O.MORGENSTERN,P.RICHTER,J.ROUVINEN,P.J.MAELKOENEN,P.VAINIOTA LO,K.HAENNINEN,M.AHL
Literature Reference Citation J.HETCYCL.CHEM.,28,1091(1991)
Literature Reference DOI 10.1002/jhet.5570280443
Molecular Weight 354.441 g/mol
Solvent DMSO-D6
Source File Reference UWCS20305