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(E)-3-(2,5-dibenzoxyphenyl)but-2-enoic acid ethyl ester
SpectraBase Compound ID CvzIcfuXYdR
InChI InChI=1S/C26H26O4/c1-3-28-26(27)16-20(2)24-17-23(29-18-21-10-6-4-7-11-21)14-15-25(24)30-19-22-12-8-5-9-13-22/h4-17H,3,18-19H2,1-2H3/b20-16+
InChIKey LWIBPOCIMSZVBX-CAPFRKAQSA-N
Mol Weight 402.49 g/mol
Molecular Formula C26H26O4
Exact Mass 402.183109 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AZK29BaYfir
Name (E)-3-(2,5-dibenzoxyphenyl)but-2-enoic acid ethyl ester
Alternate Name(s) (E)-3-[2,5-bis(phenylmethoxy)phenyl]-2-butenoic acid ethyl ester Ethyl (E)-3-(2,5-dibenzyloxyphenyl)but-2-enoate Ethyl (E)-3-[2,5-bis(phenylmethoxy)phenyl]but-2-enoate
CAS Registry Number 131636-93-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H26O4
InChI InChI=1S/C26H26O4/c1-3-28-26(27)16-20(2)24-17-23(29-18-21-10-6-4-7-11-21)14-15-25(24)30-19-22-12-8-5-9-13-22/h4-17H,3,18-19H2,1-2H3/b20-16+
InChIKey LWIBPOCIMSZVBX-CAPFRKAQSA-N
Molecular Weight 402.490 g/mol
SMILES c1(\C(=C\C(=O)OCC)C)c(OCc2ccccc2)ccc(c1)OCc1ccccc1
SPLASH splash10-0006-9000000000-33864a8bf29dc62d3a7c
Source of Spectrum J-56-1370-10
Wiley ID 1370604