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1,3,5-tris(E)-[2-(4-Pentyloxyphenyl)vinyl]benzene
SpectraBase Compound ID 32CAoOeIDJ1
InChI InChI=1S/C45H54O3/c1-4-7-10-31-46-43-25-19-37(20-26-43)13-16-40-34-41(17-14-38-21-27-44(28-22-38)47-32-11-8-5-2)36-42(35-40)18-15-39-23-29-45(30-24-39)48-33-12-9-6-3/h13-30,34-36H,4-12,31-33H2,1-3H3/b16-13+,17-14+,18-15+
InChIKey DKZYFLUYFDLSDW-NLCRRHETSA-N
Mol Weight 642.9 g/mol
Molecular Formula C45H54O3
Exact Mass 642.407296 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DP2jdMR4Cwt
Name 1,3,5-tris(E)-[2-(4-Pentyloxyphenyl)vinyl]benzene
Alternate Name(s) 1,3,5-tris((E)-4-(pentyloxy)styryl)benzene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C45H54O3
InChI InChI=1S/C45H54O3/c1-4-7-10-31-46-43-25-19-37(20-26-43)13-16-40-34-41(17-14-38-21-27-44(28-22-38)47-32-11-8-5-2)36-42(35-40)18-15-39-23-29-45(30-24-39)48-33-12-9-6-3/h13-30,34-36H,4-12,31-33H2,1-3H3/b16-13+,17-14+,18-15+
InChIKey DKZYFLUYFDLSDW-NLCRRHETSA-N
Molecular Weight 642.924 g/mol
SMILES c1(\C=C\c2cc(\C=C\c3ccc(cc3)OCCCCC)cc(\C=C\c3ccc(cc3)OCCCCC)c2)ccc(cc1)OCCCCC
SPLASH splash10-000x-0000709000-cb6c331331544a93e334
Source of Spectrum AT-54-84-43
Wiley ID 1734776