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4-(1-HEXYN-1-YL)-BENZONITRILE

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4-(1-HEXYN-1-YL)-BENZONITRILE
SpectraBase Compound ID Iry49OQ5Wmd
InChI InChI=1S/C13H13N/c1-2-3-4-5-6-12-7-9-13(11-14)10-8-12/h7-10H,2-4H2,1H3
InChIKey BUHLQBAAYDTBOA-UHFFFAOYSA-N
Mol Weight 183.25 g/mol
Molecular Formula C13H13N
Exact Mass 183.104799 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3dAl8Mi5Zau
Name 4-(1-HEXYN-1-YL)-BENZONITRILE
Compound Number 10
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C13H13N
InChI InChI=1S/C13H13N/c1-2-3-4-5-6-12-7-9-13(11-14)10-8-12/h7-10H,2-4H2,1H3
InChIKey BUHLQBAAYDTBOA-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 183.253 g/mol
Solvent CDCl3
Source File Reference UWVN23644