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5-Oxo-4-phenyl-5-(2'-pyridyl) pentanitrile

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5-Oxo-4-phenyl-5-(2'-pyridyl) pentanitrile
SpectraBase Compound ID 35bJr9hfjRS
InChI InChI=1S/C16H14N2O/c17-11-6-9-14(13-7-2-1-3-8-13)16(19)15-10-4-5-12-18-15/h1-5,7-8,10,12,14H,6,9H2
InChIKey RAIVRKASBWLLJQ-UHFFFAOYSA-N
Mol Weight 250.3 g/mol
Molecular Formula C16H14N2O
Exact Mass 250.110613 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6KUT4r7mPuO
Name 5-Oxo-4-phenyl-5-(2'-pyridyl) pentanitrile
Alternate Name(s) 5-Oxo-4-phenyl-5-(pyridin-2-yl)pentanenitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H14N2O
InChI InChI=1S/C16H14N2O/c17-11-6-9-14(13-7-2-1-3-8-13)16(19)15-10-4-5-12-18-15/h1-5,7-8,10,12,14H,6,9H2
InChIKey RAIVRKASBWLLJQ-UHFFFAOYSA-N
Literature Reference DOI 10.1039/c4cc00931b
Molecular Weight 250.301 g/mol
SMILES c1cc(ncc1)C(C(CCC#N)c1ccccc1)=O
SPLASH splash10-056r-9320000000-1e5e3dfea5f2e2d4f6ec
Source of Spectrum KD-50-5970/SMS9-3e
Wiley ID 1754494