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4-(2-((2-methoxyphenyl)ethynyl)phenyl)-2-methylbut-3-yn-2-yl acetate
SpectraBase Compound ID JNJcVtMkBSv
InChI InChI=1S/C22H20O3/c1-17(23)25-22(2,3)16-15-19-10-6-5-9-18(19)13-14-20-11-7-8-12-21(20)24-4/h5-12H,1-4H3
InChIKey FWPDHARLYUBFJO-UHFFFAOYSA-N
Mol Weight 332.4 g/mol
Molecular Formula C22H20O3
Exact Mass 332.141245 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CrPrZkEfSRd
Name 4-(2-((2-methoxyphenyl)ethynyl)phenyl)-2-methylbut-3-yn-2-yl acetate
Appearance Yellow oil
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Exact Mass 332.141244501 u
Formula C22H20O3
InChI InChI=1S/C22H20O3/c1-17(23)25-22(2,3)16-15-19-10-6-5-9-18(19)13-14-20-11-7-8-12-21(20)24-4/h5-12H,1-4H3
InChIKey FWPDHARLYUBFJO-UHFFFAOYSA-N
Instrument Name JEOL JMD-700
Ionization Type EI positive ion
Literature Reference DOI 10.1002/chem.201501725
Molecular Weight 332.399 g/mol
Reported Formula C22H20O3
SMILES C1=C(C(=CC=C1)C#CC1=CC=CC=C1OC)C#CC(OC(C)=O)(C)C
SPLASH splash10-0059-0091000000-178f1d434254b3a0f14f
Source of Spectrum QE-21-SM45-1g (DOI: 10.1002/chem.201501725)
Thin-Layer Chromatography 0.37 (PE/EA, 3:1)
Wiley ID 1907065