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4-[6-(2-phenylethynyl)-2-pyridinyl]-1-piperazinecarboxylic acid methyl ester
SpectraBase Compound ID J2rLIMqcSlB
InChI InChI=1S/C19H19N3O2/c1-24-19(23)22-14-12-21(13-15-22)18-9-5-8-17(20-18)11-10-16-6-3-2-4-7-16/h2-9H,12-15H2,1H3
InChIKey OHBXUDOKZMXHMD-UHFFFAOYSA-N
Mol Weight 321.38 g/mol
Molecular Formula C19H19N3O2
Exact Mass 321.147727 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LuUH6kBlQeb
Name 4-[6-(2-phenylethynyl)-2-pyridinyl]-1-piperazinecarboxylic acid methyl ester
Alternate Name(s) 4-[6-(2-phenylethynyl)-2-pyridyl]piperazine-1-carboxylic acid methyl ester Methyl 4-[6-(2-phenylethynyl)-2-pyridyl]piperazine-1-carboxylate Methyl 4-[6-(2-phenylethynyl)pyridin-2-yl]piperazine-1-carboxylate
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Formula C19H19N3O2
InChI InChI=1S/C19H19N3O2/c1-24-19(23)22-14-12-21(13-15-22)18-9-5-8-17(20-18)11-10-16-6-3-2-4-7-16/h2-9H,12-15H2,1H3
InChIKey OHBXUDOKZMXHMD-UHFFFAOYSA-N
Molecular Weight 321.380 g/mol
SMILES C(N1CCN(CC1)c1nc(C#Cc2ccccc2)ccc1)(=O)OC
SPLASH splash10-0a4i-1091000000-60663cb80592b38c5699
Source of Spectrum Y1-44-5616-7
Wiley ID 1621612