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3-Nitrilo-tricyclo-[2.2.1.0(2,6)]-heptane

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3-Nitrilo-tricyclo-[2.2.1.0(2,6)]-heptane
SpectraBase Compound ID DBbqngPTWab
InChI InChI=1S/C8H9N/c9-3-7-4-1-5-6(2-4)8(5)7/h4-8H,1-2H2/t4-,5+,6-,7-,8+/m0/s1
InChIKey FDHVXLDVFJFLQC-GWVFRZDISA-N
Mol Weight 119.17 g/mol
Molecular Formula C8H9N
Exact Mass 119.073499 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9DclthjK5yx
Name 3-NITRILO-TRICYCLO-[2.2.1.0(2,6)]-HEPTANE
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C8H9N
InChI InChI=1S/C8H9N/c9-3-7-4-1-5-6(2-4)8(5)7/h4-8H,1-2H2/t4-,5+,6-,7-,8+/m0/s1
InChIKey FDHVXLDVFJFLQC-GWVFRZDISA-N
Literature Reference Author M.LAJUNEN
Literature Reference Citation J.CHEM.SOC.PERKIN-2,1551(1986)
Literature Reference DOI 10.1039/p29860001551
Molecular Weight 119.166 g/mol
Solvent CDCl3
Source File Reference UWGB276