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2-[(2,4-dichlorobenzyl)thio]-4-keto-6-(2-thienyl)-5,6-dihydrothiopyran-3-carbaldehyde
SpectraBase Compound ID 4lhuH4Zi459
InChI InChI=1S/C17H12Cl2O2S3/c18-11-4-3-10(13(19)6-11)9-23-17-12(8-20)14(21)7-16(24-17)15-2-1-5-22-15/h1-6,8,16H,7,9H2
InChIKey UOILFLDXPZMEIM-UHFFFAOYSA-N
Mol Weight 415.37 g/mol
Molecular Formula C17H12Cl2O2S3
Exact Mass 413.937649 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Db7n9BNCekP
Name 2-[(2,4-dichlorobenzyl)thio]-4-keto-6-(2-thienyl)-5,6-dihydrothiopyran-3-carbaldehyde
Compound Number 1I
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Formula C17H12Cl2O2S3
InChI InChI=1S/C17H12Cl2O2S3/c18-11-4-3-10(13(19)6-11)9-23-17-12(8-20)14(21)7-16(24-17)15-2-1-5-22-15/h1-6,8,16H,7,9H2
InChIKey UOILFLDXPZMEIM-UHFFFAOYSA-N
Literature Reference Author E.KLEINPETER,M.HEYDENREICH,S.K.CHATTERJEE,W.D.RUDORF
Literature Reference Citation MAGN.RES.CHEM.,32,473(1994)
Literature Reference DOI 10.1002/mrc.1260320808
Molecular Weight 415.367 g/mol
Solvent DMSO-D6
Source File Reference UWCP2046