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(E,E)-1,3-bis[2-(4-heptyloxyphenyl)ethenyl]benzene
SpectraBase Compound ID Lkutwq39a5e
InChI InChI=1S/C36H46O2/c1-3-5-7-9-11-28-37-35-24-20-31(21-25-35)16-18-33-14-13-15-34(30-33)19-17-32-22-26-36(27-23-32)38-29-12-10-8-6-4-2/h13-27,30H,3-12,28-29H2,1-2H3/b18-16+,19-17+
InChIKey KCWRYRPLFHGFON-YWNVXTCZSA-N
Mol Weight 510.8 g/mol
Molecular Formula C36H46O2
Exact Mass 510.349781 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AzigFebF6ki
Name (E,E)-1,3-bis[2-(4-heptyloxyphenyl)ethenyl]benzene
Alternate Name(s) 1,3-bis{(E)-2-[4-(heptyloxy)phenyl]ethenyl}benzene
CAS Registry Number 114468-32-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C36H46O2
InChI InChI=1S/C36H46O2/c1-3-5-7-9-11-28-37-35-24-20-31(21-25-35)16-18-33-14-13-15-34(30-33)19-17-32-22-26-36(27-23-32)38-29-12-10-8-6-4-2/h13-27,30H,3-12,28-29H2,1-2H3/b18-16+,19-17+
InChIKey KCWRYRPLFHGFON-YWNVXTCZSA-N
Molecular Weight 510.762 g/mol
SMILES c1(\C=C\c2ccc(cc2)OCCCCCCC)cc(\C=C\c2ccc(cc2)OCCCCCCC)ccc1
SPLASH splash10-03di-1001090000-9bbbdae0820b72d8b21b
Source of Spectrum K-121-1613-3
Wiley ID 1400616