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(3E)-3-(4-methoxybenzylidene)-2-phenyl-thiochroman-4-one
SpectraBase Compound ID 9VistE7ByQf
InChI InChI=1S/C23H18O2S/c1-25-18-13-11-16(12-14-18)15-20-22(24)19-9-5-6-10-21(19)26-23(20)17-7-3-2-4-8-17/h2-15,23H,1H3/b20-15+
InChIKey DTUBZNPQKGZIDT-HMMYKYKNSA-N
Mol Weight 358.46 g/mol
Molecular Formula C23H18O2S
Exact Mass 358.102751 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JvYIcgeA5jK
Name (3E)-3-(4-methoxybenzylidene)-2-phenyl-thiochroman-4-one
Compound Number 3D-Z
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C23H18O2S
InChI InChI=1S/C23H18O2S/c1-25-18-13-11-16(12-14-18)15-20-22(24)19-9-5-6-10-21(19)26-23(20)17-7-3-2-4-8-17/h2-15,23H,1H3/b20-15+
InChIKey DTUBZNPQKGZIDT-HMMYKYKNSA-N
Literature Reference Author G.TOTH,J.HALASZ,A.LEVAI,C.NEMES,T.PATONAY
Literature Reference Citation J.CHEM.SOC.PERKIN-2,547(1996)
Literature Reference DOI 10.1039/p29960000547
Molecular Weight 358.455 g/mol
Solvent C6D6
Source File Reference UWCP8187