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2-((2-(2,2-dibromovinyl)phenyl)ethynyl)-1,3,5-trimethylbenzene
SpectraBase Compound ID HXrE7nwcMbX
InChI InChI=1S/C19H16Br2/c1-13-10-14(2)18(15(3)11-13)9-8-16-6-4-5-7-17(16)12-19(20)21/h4-7,10-12H,1-3H3
InChIKey AGNPKZHAJOAMNN-UHFFFAOYSA-N
Mol Weight 404.15 g/mol
Molecular Formula C19H16Br2
Exact Mass 401.961877 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID F6xQ47QEVTU
Name 2-((2-(2,2-dibromovinyl)phenyl)ethynyl)-1,3,5-trimethylbenzene
Appearance Colorless solid
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Exact Mass 401.961876515 u
Formula C19H16Br2
InChI InChI=1S/C19H16Br2/c1-13-10-14(2)18(15(3)11-13)9-8-16-6-4-5-7-17(16)12-19(20)21/h4-7,10-12H,1-3H3
InChIKey AGNPKZHAJOAMNN-UHFFFAOYSA-N
Instrument Name Jeol JMS-700
Ionization Type EI positive ion
Literature Reference DOI 10.1002/chem.201900996
Molecular Weight 404.145 g/mol
Reported Formula C19H16(79)Br(81)Br
SMILES C=1C=CC(C#CC2=C(C=C(C=C2C)C)C)=C(C1)C=C(Br)Br
SPLASH splash10-004i-0092000000-cb22767a2d5bc9d72c57
Source of Spectrum QE-25-SM14-S2c (DOI: 10.1002/chem.201900996)
Thin-Layer Chromatography 0.69 (PE/EA, 10:1)
Wiley ID 1893855