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1,2-Bis(5-bromo-2-hydroxy-3-butylbenzyl)benzene
SpectraBase Compound ID 1aKDltvlvNY
InChI InChI=1S/C28H32Br2O2/c1-3-5-9-21-15-25(29)17-23(27(21)31)13-19-11-7-8-12-20(19)14-24-18-26(30)16-22(28(24)32)10-6-4-2/h7-8,11-12,15-18,31-32H,3-6,9-10,13-14H2,1-2H3
InChIKey YQYMREFULKKCNA-UHFFFAOYSA-N
Mol Weight 560.4 g/mol
Molecular Formula C28H32Br2O2
Exact Mass 558.076906 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CZHQZQ3UPS0
Name 1,2-Bis(5-bromo-2-hydroxy-3-butylbenzyl)benzene
Comments Less than 3 mono-isotopic peaks
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Formula C28H32Br2O2
InChI InChI=1S/C28H32Br2O2/c1-3-5-9-21-15-25(29)17-23(27(21)31)13-19-11-7-8-12-20(19)14-24-18-26(30)16-22(28(24)32)10-6-4-2/h7-8,11-12,15-18,31-32H,3-6,9-10,13-14H2,1-2H3
InChIKey YQYMREFULKKCNA-UHFFFAOYSA-N
Molecular Weight 560.370 g/mol
SMILES Oc1c(Cc2c(Cc3c(c(cc(c3)Br)CCCC)O)cccc2)cc(cc1CCCC)Br
SPLASH splash10-0bt9-9000080000-537d906235887112dd4f
Source of Spectrum OP-31-331-3
Synonyms 4-bromo-2-[2-(5-bromo-3-butyl-2-hydroxybenzyl)benzyl]-6-butylphenol
Wiley ID 1577764