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2-ethynyl-4-methoxy-1-(phenylethynyl)benzene
SpectraBase Compound ID Ii8Ek2TGpSH
InChI InChI=1S/C17H12O/c1-3-15-13-17(18-2)12-11-16(15)10-9-14-7-5-4-6-8-14/h1,4-8,11-13H,2H3
InChIKey GQWGHDBUDOSMEB-UHFFFAOYSA-N
Mol Weight 232.28 g/mol
Molecular Formula C17H12O
Exact Mass 232.088815 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5PqbK3y3eyn
Name 2-ethynyl-4-methoxy-1-(phenylethynyl)benzene
Appearance Light yellow solid
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Exact Mass 232.088815005 u
Formula C17H12O
InChI InChI=1S/C17H12O/c1-3-15-13-17(18-2)12-11-16(15)10-9-14-7-5-4-6-8-14/h1,4-8,11-13H,2H3
InChIKey GQWGHDBUDOSMEB-UHFFFAOYSA-N
Instrument Name JEOL JMD-700
Ionization Type EI positive ion
Literature Reference DOI 10.1002/chem.201501725
Molecular Weight 232.282 g/mol
Reported Formula C17H12O
SMILES C(#C)C1=C(C=CC(=C1)OC)C#CC1=CC=CC=C1
SPLASH splash10-001i-0190000000-41518da9ab1f52d1848a
Source of Spectrum QE-21-SM23-IIIn (DOI: 10.1002/chem.201501725)
Thin-Layer Chromatography 0.53 (PE/EA, 5:1)
Wiley ID 1907134