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2-(2-(2-Methylphenyl)ethynyl)benzonitrile

View entire compound with spectra: 1 MS (GC)

2-(2-(2-Methylphenyl)ethynyl)benzonitrile
SpectraBase Compound ID 5CRES30FTPS
InChI InChI=1S/C16H11N/c1-13-6-2-3-7-14(13)10-11-15-8-4-5-9-16(15)12-17/h2-9H,1H3
InChIKey IVSBLGNLRJGMKI-UHFFFAOYSA-N
Mol Weight 217.27 g/mol
Molecular Formula C16H11N
Exact Mass 217.089149 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IvjkCuVVIgD
Name 2-(2-(2-Methylphenyl)ethynyl)benzonitrile
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H11N
InChI InChI=1S/C16H11N/c1-13-6-2-3-7-14(13)10-11-15-8-4-5-9-16(15)12-17/h2-9H,1H3
InChIKey IVSBLGNLRJGMKI-UHFFFAOYSA-N
Molecular Weight 217.271 g/mol
SMILES C(#Cc1c(C)cccc1)c1c(C#N)cccc1
SPLASH splash10-014i-0290000000-cff72cf23fc709452119
Source of Spectrum F-65-8369-3g
Wiley ID 1679515