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(E)-3-Hydroxy-4-{4-[2-(3,4,5-tri(n-propoxy)phenyl)ethenyl]phenyl}cyclobut-3-ene-dione
SpectraBase Compound ID 1M8uQXlXiib
InChI InChI=1S/C27H30O6/c1-4-13-31-21-16-19(17-22(32-14-5-2)27(21)33-15-6-3)8-7-18-9-11-20(12-10-18)23-24(28)26(30)25(23)29/h7-12,16-17,28H,4-6,13-15H2,1-3H3/b8-7+
InChIKey UMPAKUNIYAPRJL-BQYQJAHWSA-N
Mol Weight 450.53 g/mol
Molecular Formula C27H30O6
Exact Mass 450.204239 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID d898Npn0O2
Name (E)-3-Hydroxy-4-{4-[2-(3,4,5-tri(n-propoxy)phenyl)ethenyl]phenyl}cyclobut-3-ene-dione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H30O6
InChI InChI=1S/C27H30O6/c1-4-13-31-21-16-19(17-22(32-14-5-2)27(21)33-15-6-3)8-7-18-9-11-20(12-10-18)23-24(28)26(30)25(23)29/h7-12,16-17,28H,4-6,13-15H2,1-3H3/b8-7+
InChIKey UMPAKUNIYAPRJL-BQYQJAHWSA-N
Literature Reference DOI 10.1002/prac.19983400807
Molecular Weight 450.531 g/mol
SMILES OC=1C(C(=O)C1c1ccc(\C=C\c2cc(c(OCCC)c(OCCC)c2)OCCC)cc1)=O
SPLASH splash10-000f-9000200000-7abae68e9cce7f19a99b
Source of Spectrum JF-340-752-11e
Synonyms (E)-3-hydroxy-4-(4-(3,4,5-tripropoxystyryl)phenyl)cyclobut-3-ene-1,2-dione
Wiley ID 1766637