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1-Nitro-1-(phenylethynyl)-cyclohexane
SpectraBase Compound ID D42hBBfncdB
InChI InChI=1S/C14H15NO2/c16-15(17)14(10-5-2-6-11-14)12-9-13-7-3-1-4-8-13/h1,3-4,7-8H,2,5-6,10-11H2
InChIKey MZXZIUZMXIPZQE-UHFFFAOYSA-N
Mol Weight 229.28 g/mol
Molecular Formula C14H15NO2
Exact Mass 229.110279 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 14EgEHnkR7H
Name 1-Nitro-1-(phenylethynyl)-cyclohexane
CAS Registry Number 109059-20-3
Comments VARIAN XL 100 OR BRUKER MW 400 SPECTROMETER
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C14H15NO2
InChI InChI=1S/C14H15NO2/c16-15(17)14(10-5-2-6-11-14)12-9-13-7-3-1-4-8-13/h1,3-4,7-8H,2,5-6,10-11H2
InChIKey MZXZIUZMXIPZQE-UHFFFAOYSA-N
Instrument Name see comment
Literature Reference M.G. Moloney, J.T. Pinhey, E.G.Roche, J. Chem. Soc. Perkin I 333 (1989).
NMR Standard not reported
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3