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3-(4-DIMETHYLAMINOPHENYL)-2-THIOXO-1,3-THIAZEPAN-4-ONE
SpectraBase Compound ID 59bd8V08q22
InChI InChI=1S/C13H16N2OS2/c1-14(2)10-5-7-11(8-6-10)15-12(16)4-3-9-18-13(15)17/h5-8H,3-4,9H2,1-2H3
InChIKey QVGOWHDDXXXCOY-UHFFFAOYSA-N
Mol Weight 280.4 g/mol
Molecular Formula C13H16N2OS2
Exact Mass 280.070405 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 95xI0WDzLyG
Name 3-(4-DIMETHYLAMINOPHENYL)-2-THIOXO-1,3-THIAZEPAN-4-ONE
Compound Number 6P
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C13H16N2OS2
InChI InChI=1S/C13H16N2OS2/c1-14(2)10-5-7-11(8-6-10)15-12(16)4-3-9-18-13(15)17/h5-8H,3-4,9H2,1-2H3
InChIKey QVGOWHDDXXXCOY-UHFFFAOYSA-N
Literature Reference Author W.HANEFELD,H.SCHUETZ
Literature Reference Citation J.HETCYCL.CHEM.,36,1167(1999)
Literature Reference DOI 10.1002/jhet.5570360509
Molecular Weight 280.403 g/mol
Solvent CDCl3
Source File Reference UWSI24531