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1,5-Bis([(6-methoxy-phenyl)-methyl]-1,3 benzodioxol-5-yl)-2-methylidene-1,5-pentadione

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1,5-Bis([(6-methoxy-phenyl)-methyl]-1,3 benzodioxol-5-yl)-2-methylidene-1,5-pentadione
SpectraBase Compound ID LmbJvRL8End
InChI InChI=1S/C36H32O8/c1-22(36(38)30-19-35-33(42-21-44-35)17-26(30)15-24-7-11-28(40-3)12-8-24)4-13-31(37)29-18-34-32(41-20-43-34)16-25(29)14-23-5-9-27(39-2)10-6-23/h5-12,16-19H,1,4,13-15,20-21H2,2-3H3
InChIKey UVPVBBULNGUIRQ-UHFFFAOYSA-N
Mol Weight 592.6 g/mol
Molecular Formula C36H32O8
Exact Mass 592.209718 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8ZXYuJ3Jyv5
Name 1,5-Bis([(6-methoxy-phenyl)-methyl]-1,3 benzodioxol-5-yl)-2-methylidene-1,5-pentadione
CAS Registry Number 112533-20-7
Comments C32 AND C34 AT 128.60 PPM IS CHANGED TO 113.91 PPM (A.H.)
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C36H32O8
InChI InChI=1S/C36H32O8/c1-22(36(38)30-19-35-33(42-21-44-35)17-26(30)15-24-7-11-28(40-3)12-8-24)4-13-31(37)29-18-34-32(41-20-43-34)16-25(29)14-23-5-9-27(39-2)10-6-23/h5-12,16-19H,1,4,13-15,20-21H2,2-3H3
InChIKey UVPVBBULNGUIRQ-UHFFFAOYSA-N
Instrument Name Bruker WH-270
Literature Reference A.M. Echavarren, J.K. Stille, J. Am. Chem. Soc. 110, 1557 (1988).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3