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2-(4,5-DIPHENYL-[1.3]-OXATHIOL-2-YLIDENE)-MALONODINITRILE
SpectraBase Compound ID AkRIn9qXduk
InChI InChI=1S/C18H10N2OS/c19-11-15(12-20)18-21-16(13-7-3-1-4-8-13)17(22-18)14-9-5-2-6-10-14/h1-10H
InChIKey BNILMNLSDNXNSW-UHFFFAOYSA-N
Mol Weight 302.35 g/mol
Molecular Formula C18H10N2OS
Exact Mass 302.051384 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7zvR2cXlaYL
Name 2-(4,5-DIPHENYL-[1.3]-OXATHIOL-2-YLIDENE)-MALONODINITRILE
Compound Number 8
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C18H10N2OS
InChI InChI=1S/C18H10N2OS/c19-11-15(12-20)18-21-16(13-7-3-1-4-8-13)17(22-18)14-9-5-2-6-10-14/h1-10H
InChIKey BNILMNLSDNXNSW-UHFFFAOYSA-N
Literature Reference Author M.REHWALD,K.GEWALD,G.BOETTCHER
Literature Reference Citation HETEROCYCLES,45,493(1997)
Literature Reference DOI 10.3987/COM-96-7702
Molecular Weight 302.350 g/mol
Solvent CDCl3
Source File Reference UWMZ2298