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1,4-DIHYDRO-1,4-DIOXO-ALPHA-1,3-DITHIAN-2-YLIDENE-3-(1-PYRROLIDINYL)-2-NAPHTHALENE-ACETONITRILE
SpectraBase Compound ID 2Qxs25tiGj5
InChI InChI=1S/C20H18N2O2S2/c21-12-15(20-25-10-5-11-26-20)16-17(22-8-3-4-9-22)19(24)14-7-2-1-6-13(14)18(16)23/h1-2,6-7H,3-5,8-11H2
InChIKey FEXHVHNZABLPFQ-UHFFFAOYSA-N
Mol Weight 382.5 g/mol
Molecular Formula C20H18N2O2S2
Exact Mass 382.08097 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KMGcsvxGSJw
Name 1,4-DIHYDRO-1,4-DIOXO-ALPHA-1,3-DITHIAN-2-YLIDENE-3-(1-PYRROLIDINYL)-2-NAPHTHALENE-ACETONITRILE
Compound Number 34
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H18N2O2S2
InChI InChI=1S/C20H18N2O2S2/c21-12-15(20-25-10-5-11-26-20)16-17(22-8-3-4-9-22)19(24)14-7-2-1-6-13(14)18(16)23/h1-2,6-7H,3-5,8-11H2
InChIKey FEXHVHNZABLPFQ-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 382.495 g/mol
Solvent CDCl3
Source File Reference UNIW20955