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3-({3-ethyl-6-[2-(pyridin-3-yl)piperidin-1-yl]hex-4-yn-3-yl}oxy)propanenitrile
SpectraBase Compound ID 6Xzvo0TFM99
InChI InChI=1S/C21H29N3O/c1-3-21(4-2,25-17-9-13-22)12-8-16-24-15-6-5-11-20(24)19-10-7-14-23-18-19/h7,10,14,18,20H,3-6,9,11,15-17H2,1-2H3
InChIKey RIVTVWBERKXSNN-UHFFFAOYSA-N
Mol Weight 339.48 g/mol
Molecular Formula C21H29N3O
Exact Mass 339.231063 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3LmilZ9yHSS
Name 3-({3-ethyl-6-[2-(pyridin-3-yl)piperidin-1-yl]hex-4-yn-3-yl}oxy)propanenitrile
Alternate Name(s) 3-[3-ethyl-6-[2-(3-pyridinyl)-1-piperidinyl]hex-4-yn-3-yl]oxypropanenitrile 3-[1,1-diethyl-4-[2-(3-pyridyl)-1-piperidyl]but-2-ynoxy]propanenitrile 3-[3-ethyl-6-(2-pyridin-3-ylpiperidin-1-yl)hex-4-yn-3-yl]oxypropanenitrile
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Formula C21H29N3O
InChI InChI=1S/C21H29N3O/c1-3-21(4-2,25-17-9-13-22)12-8-16-24-15-6-5-11-20(24)19-10-7-14-23-18-19/h7,10,14,18,20H,3-6,9,11,15-17H2,1-2H3
InChIKey RIVTVWBERKXSNN-UHFFFAOYSA-N
Molecular Weight 339.483 g/mol
SMILES C1CCN(C(c2cnccc2)C1)CC#CC(OCCC#N)(CC)CC
SPLASH splash10-03di-1296000000-30a1d5a11fa180edfeb5
Source of Spectrum IY-2-5184-6
Wiley ID 1659829