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1-(Phenylethynyl)-2-(phenylprop-1-en-2-yl)benzene
SpectraBase Compound ID Auk4CS6obOr
InChI InChI=1S/C23H18/c1-19(18-21-12-6-3-7-13-21)23-15-9-8-14-22(23)17-16-20-10-4-2-5-11-20/h2-15,18H,1H3
InChIKey NUUSTWWYIIHZCI-UHFFFAOYSA-N
Mol Weight 294.4 g/mol
Molecular Formula C23H18
Exact Mass 294.140851 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 71yZRhtJzhh
Name 1-(Phenylethynyl)-2-(phenylprop-1-en-2-yl)benzene
Appearance Yellow oil
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Exact Mass 294.140850580 u
Formula C23H18
GC Column HP-5MS
InChI InChI=1S/C23H18/c1-19(18-21-12-6-3-7-13-21)23-15-9-8-14-22(23)17-16-20-10-4-2-5-11-20/h2-15,18H,1H3
InChIKey NUUSTWWYIIHZCI-UHFFFAOYSA-N
Instrument Name Agilent 6890N-5973
Ionization Type EI
Literature Reference DOI 10.1002/chem.201405789
SMILES C1=CC(=C(C=C1)C#CC1=CC=CC=C1)C(C)=CC1=CC=CC=C1
SPLASH splash10-00ou-0090000000-c626b4b6b7cb25f65d59
Sample Comments Major isomer, dr = ~1.5:1
Source of Spectrum QE-21-SM4-2c (DOI: 10.1002/chem.201405789)
Thin-Layer Chromatography 0.5 (hexane/EtOAc, 9:1)
Wiley ID 1907695