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1-(6-Methoxypyridin-3-yl)-3-phenylprop-2-yn-1-one
SpectraBase Compound ID BHwCkT3Jhbs
InChI InChI=1S/C15H11NO2/c1-18-15-10-8-13(11-16-15)14(17)9-7-12-5-3-2-4-6-12/h2-6,8,10-11H,1H3
InChIKey RDAVHHTZKCRUDG-UHFFFAOYSA-N
Mol Weight 237.26 g/mol
Molecular Formula C15H11NO2
Exact Mass 237.078979 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KrOcVsRMiJ2
Name 1-(6-Methoxypyridin-3-yl)-3-phenylprop-2-yn-1-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H11NO2
InChI InChI=1S/C15H11NO2/c1-18-15-10-8-13(11-16-15)14(17)9-7-12-5-3-2-4-6-12/h2-6,8,10-11H,1H3
InChIKey RDAVHHTZKCRUDG-UHFFFAOYSA-N
Literature Reference DOI 10.1002/anie.201103296
Molecular Weight 237.258 g/mol
SMILES c1(ccc(nc1)OC)C(=O)C#Cc1ccccc1
SPLASH splash10-000i-0490000000-785f147c9abe29b2a2e3
Source of Spectrum ACI-50-SM31-5i
Wiley ID 1780015