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2-(4-BENZYLOXYBENZYL)-2-(3,4-DIMETHOXYPHENYL)-1,3-DITHIANE
SpectraBase Compound ID 6PXlk3YajX
InChI InChI=1S/C26H28O3S2/c1-27-24-14-11-22(17-25(24)28-2)26(30-15-6-16-31-26)18-20-9-12-23(13-10-20)29-19-21-7-4-3-5-8-21/h3-5,7-14,17H,6,15-16,18-19H2,1-2H3
InChIKey QPNDFJKMNJQQBM-UHFFFAOYSA-N
Mol Weight 452.63 g/mol
Molecular Formula C26H28O3S2
Exact Mass 452.147987 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BEugxLXhAet
Name 2-(4-BENZYLOXYBENZYL)-2-(3,4-DIMETHOXYPHENYL)-1,3-DITHIANE
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C26H28O3S2
InChI InChI=1S/C26H28O3S2/c1-27-24-14-11-22(17-25(24)28-2)26(30-15-6-16-31-26)18-20-9-12-23(13-10-20)29-19-21-7-4-3-5-8-21/h3-5,7-14,17H,6,15-16,18-19H2,1-2H3
InChIKey QPNDFJKMNJQQBM-UHFFFAOYSA-N
Literature Reference Author M.MEDARDE,R.P.L.DECLAIRAC,J.L.LOPEZ,A.SANFELICIANO
Literature Reference Citation J.NAT.PROD.,57,1136(1994)
Literature Reference DOI 10.1021/np50110a002
Molecular Weight 452.627 g/mol
Solvent CDCl3
Source File Reference UWRK60