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1-[2'-Pyridyl]-5-phenyl-3-oxo-4-penten-1-yne
SpectraBase Compound ID 5CG03vzPikZ
InChI InChI=1S/C16H11NO/c18-16(11-9-14-6-2-1-3-7-14)12-10-15-8-4-5-13-17-15/h1-9,11,13H/b11-9+
InChIKey CPRKWZZMXFNARM-PKNBQFBNSA-N
Mol Weight 233.27 g/mol
Molecular Formula C16H11NO
Exact Mass 233.084064 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1KSG0mtX96
Name 1-[2'-Pyridyl]-5-phenyl-3-oxo-4-penten-1-yne
Alternate Name(s) (1E)-1-phenyl-5-(2-pyridinyl)-1-penten-4-yn-3-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H11NO
InChI InChI=1S/C16H11NO/c18-16(11-9-14-6-2-1-3-7-14)12-10-15-8-4-5-13-17-15/h1-9,11,13H/b11-9+
InChIKey CPRKWZZMXFNARM-PKNBQFBNSA-N
Molecular Weight 233.270 g/mol
SMILES C(#CC(\C=C\c1ccccc1)=O)c1ccccn1
SPLASH splash10-0f89-0190000000-ee0bd1f7a0602791e424
Source of Spectrum F6-138-21-3
Wiley ID 1612237