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4-(4-CHLOROPHENYL)-7,7-DIMETHYL-5-OXO-1,2,3,4,5,6,7,8-OCTAHYDROQUINAZOLINE-2-THIONE
SpectraBase Compound ID 1KqKeetVmjG
InChI InChI=1S/C16H17ClN2OS/c1-16(2)7-11-13(12(20)8-16)14(19-15(21)18-11)9-3-5-10(17)6-4-9/h3-6,14H,7-8H2,1-2H3,(H2,18,19,21)
InChIKey OWPRMEFFFJZSHK-UHFFFAOYSA-N
Mol Weight 320.84 g/mol
Molecular Formula C16H17ClN2OS
Exact Mass 320.075012 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6vhYYZGERgv
Name 4-(4-CHLOROPHENYL)-7,7-DIMETHYL-5-OXO-1,2,3,4,5,6,7,8-OCTAHYDROQUINAZOLINE-2-THIONE
Compound Number 3B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C16H17ClN2OS
InChI InChI=1S/C16H17ClN2OS/c1-16(2)7-11-13(12(20)8-16)14(19-15(21)18-11)9-3-5-10(17)6-4-9/h3-6,14H,7-8H2,1-2H3,(H2,18,19,21)
InChIKey OWPRMEFFFJZSHK-UHFFFAOYSA-N
Literature Reference Author M.KIDWAI,S.SAXENA,R.MOHAN
Literature Reference Citation J.HETCYCL.CHEM.,42,703(2005)
Literature Reference DOI 10.1002/jhet.5570420435
Molecular Weight 320.837 g/mol
Sample ID 53096
Solvent CDCl3