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2-Chloro-2a-phenyl-2R,2ac, 3ac,4,5,6,7,7ac-octahydro-1H,8H-azeto(2,1-B)(1,3)benzthiazin-1-one

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2-Chloro-2a-phenyl-2R,2ac, 3ac,4,5,6,7,7ac-octahydro-1H,8H-azeto(2,1-B)(1,3)benzthiazin-1-one
SpectraBase Compound ID AaOfqqKi3ie
InChI InChI=1S/C16H18ClNOS/c17-14-15(19)18-10-11-6-4-5-9-13(11)20-16(14,18)12-7-2-1-3-8-12/h1-3,7-8,11,13-14H,4-6,9-10H2
InChIKey KKYBLLGXNICIQB-UHFFFAOYSA-N
Mol Weight 307.84 g/mol
Molecular Formula C16H18ClNOS
Exact Mass 307.079763 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BTnjaSwCeyA
Name 2-Chloro-2a-phenyl-2R,2ac, 3at,4,5,6,7,7ac-octahydro-1H,8H-azeto(2,1-B)(1,3)benzthiazin-1-one
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Formula C16H18ClNOS
InChI InChI=1S/C16H18ClNOS/c17-14-15(19)18-10-11-6-4-5-9-13(11)20-16(14,18)12-7-2-1-3-8-12/h1-3,7-8,11,13-14H,4-6,9-10H2
InChIKey KKYBLLGXNICIQB-UHFFFAOYSA-N
Instrument Name Bruker WP-80
Literature Reference P. Sohar, J. Szabo, L. Simon, Magn. Res. Chem. 29, 687 (1991).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3