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3-Bromo-1,4-dimethoxy.alpha.-[[[(4-methylphenyl)-sulfonyl]-oxy]-methylene]-2-naphthalene-acetonitrile

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3-Bromo-1,4-dimethoxy.alpha.-[[[(4-methylphenyl)-sulfonyl]-oxy]-methylene]-2-naphthalene-acetonitrile
SpectraBase Compound ID BwufQYrriCf
InChI InChI=1S/C22H18BrNO5S/c1-14-8-10-16(11-9-14)30(25,26)29-13-15(12-24)19-20(23)22(28-3)18-7-5-4-6-17(18)21(19)27-2/h4-11,13H,1-3H3/b15-13+
InChIKey SOLCTHQAISSLQU-FYWRMAATSA-N
Mol Weight 488.35 g/mol
Molecular Formula C22H18BrNO5S
Exact Mass 487.008907 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BX7fkC5p9DW
Name 3-Bromo-1,4-dimethoxy.alpha.-[[[(4-methylphenyl)-sulfonyl]-oxy]-methylene]-2-naphthalene-acetonitrile
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Formula C22H18BrNO5S
InChI InChI=1S/C22H18BrNO5S/c1-14-8-10-16(11-9-14)30(25,26)29-13-15(12-24)19-20(23)22(28-3)18-7-5-4-6-17(18)21(19)27-2/h4-11,13H,1-3H3/b15-13+
InChIKey SOLCTHQAISSLQU-FYWRMAATSA-N
Instrument Name SF = 200 MHz
Literature Reference J. Org. Chem. 53, 2278 (1988).
NMR Standard not reported
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3