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3-Bromo-1,4-dimethoxy.alpha.-1,3-dithiolan-2-ylidene-2-naphthalene-acetonitrile
SpectraBase Compound ID IiKG6JaCMvL
InChI InChI=1S/C17H14BrNO2S2/c1-21-16-11-5-3-2-4-10(11)13(9-20)15(18)14(16)12(8-19)17-22-6-7-23-17/h2-5,20H,6-7,9H2,1H3
InChIKey KGZJJPVYHAQFMQ-UHFFFAOYSA-N
Mol Weight 408.33 g/mol
Molecular Formula C17H14BrNO2S2
Exact Mass 406.964934 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GFrxZ6zqEZV
Name 3-BROMO-1,4-DIMETHOXY-ALPHA-1,3-DITHIOLAN-2-YLIDENE-2-NAPHTHALENE-ACETONITRILE
Compound Number 27
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C17H14BrNO2S2
InChI InChI=1S/C17H14BrNO2S2/c1-21-16-11-5-3-2-4-10(11)13(9-20)15(18)14(16)12(8-19)17-22-6-7-23-17/h2-5,20H,6-7,9H2,1H3
InChIKey KGZJJPVYHAQFMQ-UHFFFAOYSA-N
Literature Reference Author E.O.M.ORLEMANS,B.H.M.LAMMERINK,F.C.J.M.VANVEGGEL,W.VERBOOM,S .HARKEMA,D.N.REINHOU
Literature Reference Citation J.ORG.CHEM.,53,2278(1988)
Literature Reference DOI 10.1021/jo00245a028
Molecular Weight 408.328 g/mol
Solvent CDCl3
Source File Reference UNIW20950