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(1-(2-Bromophenyl)but-3-yne-2,2-diyl)dibenzene
SpectraBase Compound ID 62Auq77wEP6
InChI InChI=1S/C22H17Br/c1-2-22(19-12-5-3-6-13-19,20-14-7-4-8-15-20)17-18-11-9-10-16-21(18)23/h1,3-16H,17H2
InChIKey USFIDQIMKAQETD-UHFFFAOYSA-N
Mol Weight 361.28 g/mol
Molecular Formula C22H17Br
Exact Mass 360.051364 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KDodXpbmUNw
Name (1-(2-Bromophenyl)but-3-yne-2,2-diyl)dibenzene
Appearance White solid
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Exact Mass 360.051363547 u
Formula C22H17Br
InChI InChI=1S/C22H17Br/c1-2-22(19-12-5-3-6-13-19,20-14-7-4-8-15-20)17-18-11-9-10-16-21(18)23/h1,3-16H,17H2
InChIKey USFIDQIMKAQETD-UHFFFAOYSA-N
Ionization Type EI
Literature Reference DOI 10.1002/chem.201501797
Molecular Weight 361.282 g/mol
SMILES C=1C=CC=C(CC(C#C)(C=2C=CC=CC2)C=2C=CC=CC2)C1Br
SPLASH splash10-0006-0900000000-5f128ddbe859258534ed
Source of Spectrum QE-21-SM41-48 (DOI: 10.1002/chem.201501797)
Thin-Layer Chromatography 0.13 (n-pentane/EtOAc, 500:1)
Wiley ID 1909293