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4-(Phenylethynyl)benzonitrile

View entire compound with spectra: 2 NMR, and 9 MS (GC)

4-(Phenylethynyl)benzonitrile
SpectraBase Compound ID 2Y7DZtgz4Ql
InChI InChI=1S/C15H9N/c16-12-15-10-8-14(9-11-15)7-6-13-4-2-1-3-5-13/h1-5,8-11H
InChIKey JVUBQICKOVCBNM-UHFFFAOYSA-N
Mol Weight 203.24 g/mol
Molecular Formula C15H9N
Exact Mass 203.073499 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4uM0hV1eIei
Name 4-PHENYLETHYNYLBENZONITRILE
Compound Number 30
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C15H9N
InChI InChI=1S/C15H9N/c16-12-15-10-8-14(9-11-15)7-6-13-4-2-1-3-5-13/h1-5,8-11H
InChIKey JVUBQICKOVCBNM-UHFFFAOYSA-N
Literature Reference Author G.A.MOLANDER,B.W.KATONA,F.MACHROUHI
Literature Reference Citation J.ORG.CHEM.,67,8416(2002)
Literature Reference DOI 10.1021/jo0262356
Molecular Weight 203.243 g/mol
Solvent CDCl3
Source File Reference UWVN23663