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3-(4-Chloro-phenyl)-5-morpholino-1,4,2-dithiazol #2121

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3-(4-Chloro-phenyl)-5-morpholino-1,4,2-dithiazol #2121
SpectraBase Compound ID 7HCuPL3rppf
InChI InChI=1S/C12H12ClN2OS2/c13-10-3-1-9(2-4-10)11-14-18-12(17-11)15-5-7-16-8-6-15/h1-4H,5-8H2/q+1
InChIKey ZJIBWZSAYKMTNL-UHFFFAOYSA-N
Mol Weight 299.81 g/mol
Molecular Formula C12H12ClN2OS2
Exact Mass 299.007958 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7PE7sFKYrQf
Name 3-(4-Chloro-phenyl)-5-morpholino-1,4,2-dithiazol #2121
Comments tetrafluoroborate
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C12H12ClN2OS2
InChI InChI=1S/C12H12ClN2OS2/c13-10-3-1-9(2-4-10)11-14-18-12(17-11)15-5-7-16-8-6-15/h1-4H,5-8H2/q+1
InChIKey ZJIBWZSAYKMTNL-UHFFFAOYSA-N
Instrument Name Jeol FX-90
Literature Reference F.S. Chan, M.P. Sammes, R.L.Harlow, J. Chem. Soc. Perkin I 899 (1988).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CD3CN