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1-Nitro-1-(4-trifluoromethyl-phenylethynyl)-cyclohexane
SpectraBase Compound ID FRAKkFlngU
InChI InChI=1S/C15H14F3NO2/c16-15(17,18)13-6-4-12(5-7-13)8-11-14(19(20)21)9-2-1-3-10-14/h4-7H,1-3,9-10H2
InChIKey ZXYNACJLTGOZQN-UHFFFAOYSA-N
Mol Weight 297.28 g/mol
Molecular Formula C15H14F3NO2
Exact Mass 297.097663 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID F6k1vcLNFKm
Name 1-Nitro-1-(4-trifluoromethyl-phenylethynyl)-cyclohexane
Comments VARIAN XL 100 OR BRUKER MW 400 SPECTROMETER
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C15H14F3NO2
InChI InChI=1S/C15H14F3NO2/c16-15(17,18)13-6-4-12(5-7-13)8-11-14(19(20)21)9-2-1-3-10-14/h4-7H,1-3,9-10H2
InChIKey ZXYNACJLTGOZQN-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