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1-((4-(tert-butyl)phenyl)ethynyl)-2-(2,2-dibromovinyl)benzene
SpectraBase Compound ID G1JpulJ1XSr
InChI InChI=1S/C20H18Br2/c1-20(2,3)18-12-9-15(10-13-18)8-11-16-6-4-5-7-17(16)14-19(21)22/h4-7,9-10,12-14H,1-3H3
InChIKey HOSWHRMYVOEWDU-UHFFFAOYSA-N
Mol Weight 418.17 g/mol
Molecular Formula C20H18Br2
Exact Mass 415.977527 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8R1cfYGxHRh
Name 1-((4-(tert-butyl)phenyl)ethynyl)-2-(2,2-dibromovinyl)benzene
Appearance Orange oil
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Exact Mass 415.977526580 u
Formula C20H18Br2
InChI InChI=1S/C20H18Br2/c1-20(2,3)18-12-9-15(10-13-18)8-11-16-6-4-5-7-17(16)14-19(21)22/h4-7,9-10,12-14H,1-3H3
InChIKey HOSWHRMYVOEWDU-UHFFFAOYSA-N
Instrument Name Jeol JMS-700
Ionization Type EI positive ion
Literature Reference DOI 10.1002/chem.201900996
Molecular Weight 418.172 g/mol
Reported Formula C20H18(79)Br(81)Br
SMILES C=1C=CC(C#CC2=CC=C(C=C2)C(C)(C)C)=C(C1)C=C(Br)Br
SPLASH splash10-0udr-0095000000-d23edfd918d0a53e229d
Source of Spectrum QE-25-SM14-S2b (DOI: 10.1002/chem.201900996)
Thin-Layer Chromatography 0.69 (PE/EA, 10:1)
Wiley ID 1893854