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2-[[2-(Pyridin-3-ylethynyl)benzyl]oxy]benzonitrile
SpectraBase Compound ID KbDXImCPOi3
InChI InChI=1S/C21H14N2O/c22-14-19-8-3-4-10-21(19)24-16-20-9-2-1-7-18(20)12-11-17-6-5-13-23-15-17/h1-10,13,15H,16H2
InChIKey WSIUJOVSYHYSQH-UHFFFAOYSA-N
Mol Weight 310.36 g/mol
Molecular Formula C21H14N2O
Exact Mass 310.110613 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FTyKxqjMscK
Name 2-[[2-(Pyridin-3-ylethynyl)benzyl]oxy]benzonitrile
Alternate Name(s) 2-((2-(pyridin-3-ylethynyl)benzyl)oxy)benzonitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H14N2O
InChI InChI=1S/C21H14N2O/c22-14-19-8-3-4-10-21(19)24-16-20-9-2-1-7-18(20)12-11-17-6-5-13-23-15-17/h1-10,13,15H,16H2
InChIKey WSIUJOVSYHYSQH-UHFFFAOYSA-N
Literature Reference DOI 10.1021/acs.joc.5b01884
Molecular Weight 310.356 g/mol
SMILES C(c1c(cccc1)OCc1c(cccc1)C#Cc1cnccc1)#N
SPLASH splash10-00kf-0910000000-e0e953f1f02c46d98fc1
Source of Spectrum J-80-10284-1k
Wiley ID 1801687