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2-Bromo-5-methoxy-1-(2-phenylethynyl)benzene
SpectraBase Compound ID INCI1QvpTRu
InChI InChI=1S/C15H11BrO/c1-17-14-9-10-15(16)13(11-14)8-7-12-5-3-2-4-6-12/h2-6,9-11H,1H3
InChIKey KDMFLXRMFJDTDF-UHFFFAOYSA-N
Mol Weight 287.16 g/mol
Molecular Formula C15H11BrO
Exact Mass 285.999328 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3G4nsiQF0J2
Name 2-Bromo-5-methoxy-1-(2-phenylethynyl)benzene
Alternate Name(s) 1-bromo-4-methoxy-2-(phenylethynyl)benzene 4-bromo-3-(phenylethynyl)phenyl methyl ether
Comments Less than 3 mono-isotopic peaks
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Formula C15H11BrO
InChI InChI=1S/C15H11BrO/c1-17-14-9-10-15(16)13(11-14)8-7-12-5-3-2-4-6-12/h2-6,9-11H,1H3
InChIKey KDMFLXRMFJDTDF-UHFFFAOYSA-N
Molecular Weight 287.156 g/mol
SMILES C(#Cc1ccccc1)c1c(ccc(c1)OC)Br
SPLASH splash10-000i-0090000000-fc260f5637f6fd61ea22
Source of Spectrum AT-34-3104-5
Wiley ID 852428