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1-Bromo-2-(buta-1,3-dienyl)-4,5-dimethoxybenzene
SpectraBase Compound ID 9eE8hF3M44T
InChI InChI=1S/C12H13BrO2/c1-4-5-6-9-7-11(14-2)12(15-3)8-10(9)13/h4-8H,1H2,2-3H3
InChIKey UOQHSZZILZWWFU-UHFFFAOYSA-N
Mol Weight 269.14 g/mol
Molecular Formula C12H13BrO2
Exact Mass 268.009893 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9ZAaf8wFyq4
Name 1-Bromo-2-(buta-1,3-dienyl)-4,5-dimethoxybenzene
Appearance Yellow solid
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Formula C12H13BrO2
InChI InChI=1S/C12H13BrO2/c1-4-5-6-9-7-11(14-2)12(15-3)8-10(9)13/h4-8H,1H2,2-3H3
InChIKey UOQHSZZILZWWFU-UHFFFAOYSA-N
Instrument Name Agilent 6890-Hewlett Packard 5973
Ionization Type EI positive ion
Literature Reference DOI 10.3762/bjoc.11.18
Molecular Weight 269.138 g/mol
Reported Formula C12H13O2Br
SMILES c1(Br)c(cc(c(c1)OC)OC)C=CC=C
SPLASH splash10-0avr-0900000000-7c54040cacce5480908a
Sample Comments E/Z = 73:27
Source of Spectrum BJO-11-SM13-1i
Wiley ID 1851538