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3-(4-CHLOROPHENYL)-3,4-DIHYDRO-4-OXO-QUINAZOLINE-2-CARBONITRILE
SpectraBase Compound ID 9UwS2TStrtH
InChI InChI=1S/C15H8ClN3O/c16-10-5-7-11(8-6-10)19-14(9-17)18-13-4-2-1-3-12(13)15(19)20/h1-8H
InChIKey BFDIECPUSWKWBI-UHFFFAOYSA-N
Mol Weight 281.7 g/mol
Molecular Formula C15H8ClN3O
Exact Mass 281.03559 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Cz0MQYUORRh
Name 3-(4-CHLOROPHENYL)-3,4-DIHYDRO-4-OXO-QUINAZOLINE-2-CARBONITRILE
Compound Number 8E
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C15H8ClN3O
InChI InChI=1S/C15H8ClN3O/c16-10-5-7-11(8-6-10)19-14(9-17)18-13-4-2-1-3-12(13)15(19)20/h1-8H
InChIKey BFDIECPUSWKWBI-UHFFFAOYSA-N
Literature Reference Author L.M.DECK,E.P.PAPADOPOULOS,K.A.SMITH
Literature Reference Citation J.HETCYCL.CHEM.,40,885(2003)
Literature Reference DOI 10.1002/jhet.5570400522
Molecular Weight 281.701 g/mol
Solvent DMSO-D6
Source File Reference UWMS22855