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(E)-2-(3-Bromophenyl)-1-[3,4,5-tris(dodecyloxy)phenyl]propene
SpectraBase Compound ID 2KqizqDfaCm
InChI InChI=1S/C51H85BrO3/c1-5-8-11-14-17-20-23-26-29-32-38-53-49-42-46(41-45(4)47-36-35-37-48(52)44-47)43-50(54-39-33-30-27-24-21-18-15-12-9-6-2)51(49)55-40-34-31-28-25-22-19-16-13-10-7-3/h35-37,41-44H,5-34,38-40H2,1-4H3/b45-41+
InChIKey SRVXEZHHRIHDGV-LYMKOHMFSA-N
Mol Weight 826.1 g/mol
Molecular Formula C51H85BrO3
Exact Mass 824.56821 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID I5TOsGjzcrK
Name E-2-(3'-Bromophenyl)-1- [ 3',4',5'-tris(dodecyloxy)phenyl]propene
Alternate Name(s) 5-[(1E)-2-(3-bromophenyl)prop-1-en-1-yl]-1,2,3-tris(dodecyloxy)benzene
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Formula C51H85BrO3
InChI InChI=1S/C51H85BrO3/c1-5-8-11-14-17-20-23-26-29-32-38-53-49-42-46(41-45(4)47-36-35-37-48(52)44-47)43-50(54-39-33-30-27-24-21-18-15-12-9-6-2)51(49)55-40-34-31-28-25-22-19-16-13-10-7-3/h35-37,41-44H,5-34,38-40H2,1-4H3/b45-41+
InChIKey SRVXEZHHRIHDGV-LYMKOHMFSA-N
Molecular Weight 826.142 g/mol
SMILES c1(c(cc(\C=C\(c2cc(Br)ccc2)C)cc1OCCCCCCCCCCCC)OCCCCCCCCCCCC)OCCCCCCCCCCCC
SPLASH splash10-0adl-9011001070-de31f210b532068a2557
Source of Spectrum K-127-1741-12
Wiley ID 1417483