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1,3-bis[(E)-2-(3,4-dimethoxyphenyl)ethenyl]-5-methoxy-benzene
SpectraBase Compound ID TybkmdskL8
InChI InChI=1S/C27H28O5/c1-28-23-15-21(8-6-19-10-12-24(29-2)26(17-19)31-4)14-22(16-23)9-7-20-11-13-25(30-3)27(18-20)32-5/h6-18H,1-5H3/b8-6+,9-7+
InChIKey JLBVIOMDJZTLIM-CDJQDVQCSA-N
Mol Weight 432.52 g/mol
Molecular Formula C27H28O5
Exact Mass 432.193674 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AP2ugKrdizL
Name 1,3-bis[(E)-2-(3,4-dimethoxyphenyl)ethenyl]-5-methoxy-benzene
Alternate Name(s) 1,3-bis[(E)-2-(3,4-dimethoxyphenyl)vinyl]-5-methoxy-benzene
CAS Registry Number 114468-39-2
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H28O5
InChI InChI=1S/C27H28O5/c1-28-23-15-21(8-6-19-10-12-24(29-2)26(17-19)31-4)14-22(16-23)9-7-20-11-13-25(30-3)27(18-20)32-5/h6-18H,1-5H3/b8-6+,9-7+
InChIKey JLBVIOMDJZTLIM-CDJQDVQCSA-N
Molecular Weight 432.516 g/mol
SMILES c1(c(ccc(\C=C\c2cc(\C=C\c3cc(OC)c(cc3)OC)cc(c2)OC)c1)OC)OC
SPLASH splash10-001i-0100900000-9e668e4a3f5c5a8b0bfb
Source of Spectrum K-121-1613-3
Wiley ID 1382437