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3-(4-CHLOROPHENYL)-2-THIOXO-1,3-THIAZEPAN-4-ONE

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3-(4-CHLOROPHENYL)-2-THIOXO-1,3-THIAZEPAN-4-ONE
SpectraBase Compound ID 60OC0rAHbIl
InChI InChI=1S/C11H10ClNOS2/c12-8-3-5-9(6-4-8)13-10(14)2-1-7-16-11(13)15/h3-6H,1-2,7H2
InChIKey CTNYUNXFPPFGQM-UHFFFAOYSA-N
Mol Weight 271.78 g/mol
Molecular Formula C11H10ClNOS2
Exact Mass 270.989234 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GbAJDFt7bO2
Name 3-(4-CHLOROPHENYL)-2-THIOXO-1,3-THIAZEPAN-4-ONE
Compound Number 6M
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C11H10ClNOS2
InChI InChI=1S/C11H10ClNOS2/c12-8-3-5-9(6-4-8)13-10(14)2-1-7-16-11(13)15/h3-6H,1-2,7H2
InChIKey CTNYUNXFPPFGQM-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 271.780 g/mol
Solvent CDCl3
Source File Reference UWSI24529