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E-2-(3'-Bromophenyl)-1- [ 2',3',4'-tris(hexyloxy)phenyl]propene
SpectraBase Compound ID Hu9ID9RJsOD
InChI InChI=1S/C33H49BrO3/c1-5-8-11-14-22-35-31-21-20-29(25-27(4)28-18-17-19-30(34)26-28)32(36-23-15-12-9-6-2)33(31)37-24-16-13-10-7-3/h17-21,25-26H,5-16,22-24H2,1-4H3/b27-25+
InChIKey PBBSERYZNZFRNS-IMVLJIQESA-N
Mol Weight 573.7 g/mol
Molecular Formula C33H49BrO3
Exact Mass 572.286508 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B1YKrFYL2XY
Name E-2-(3'-Bromophenyl)-1- [ 2',3',4'-tris(hexyloxy)phenyl]propene
Alternate Name(s) 1-[(1E)-2-(3-bromophenyl)-1-propenyl]-2,3,4-tris(hexyloxy)benzene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C33H49BrO3
InChI InChI=1S/C33H49BrO3/c1-5-8-11-14-22-35-31-21-20-29(25-27(4)28-18-17-19-30(34)26-28)32(36-23-15-12-9-6-2)33(31)37-24-16-13-10-7-3/h17-21,25-26H,5-16,22-24H2,1-4H3/b27-25+
InChIKey PBBSERYZNZFRNS-IMVLJIQESA-N
Molecular Weight 573.656 g/mol
SMILES c1(c(c(\C=C\(c2cc(Br)ccc2)C)ccc1OCCCCCC)OCCCCCC)OCCCCCC
SPLASH splash10-00dl-8001090000-9a942429d794cd7b5b0c
Source of Spectrum K-127-1741-12
Wiley ID 1407875