John Wiley & Sons, Inc. SpectraBase; SpectraBase Compound ID=FyFZGcgoTQ8

(accessed ).
1-CYANO-BICYCLO-[1.1.1]-PENTANE
SpectraBase Compound ID FyFZGcgoTQ8
InChI InChI=1S/C6H7N/c7-4-6-1-5(2-6)3-6/h5H,1-3H2
InChIKey AOUMEYPKBXRHIU-UHFFFAOYSA-N
Mol Weight 93.13 g/mol
Molecular Formula C6H7N
Exact Mass 93.057849 g/mol
Copyright Copyright © 2016-2020 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent CDCl3
Copyright Copyright © 2016-2020 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent CDCl3
Copyright Copyright © 2016-2020 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent CDCl3
Copyright Copyright © 2016-2020 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent CDCl3
  • AOUMEYPKBXRHIU-UHFFFAOYSA-N
  • BICYCLO-[1.1.1]-PENTANE-1-((13)C)-CARBONITRILE
Title Journal or Book Year
Influence ofσ-hyperconjugative interactions on13C substituent chemical shifts: experimental and theoretical study in 1-X,3-CH3-bicyclo[1.1.1]pentanes Magnetic Resonance in Chemistry 2004
Transmission of polar substituent effects across the bicyclo[1.1.1]pentane ring system as monitored by19F NMR shifts Magnetic Resonance in Chemistry 2000
A DFT/GIAO/NBO and experimental study of13C SCSs in 1-X-bicyclo[1.1.1]pentanes Magnetic Resonance in Chemistry 2000
Coupling to sp-Hybridized Carbon: 13C-13C Coupling Constants in Some Polycycloalkanecarbonitriles Australian Journal of Chemistry 1989
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