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1-Methyl-1-(4-nitro-phenyl)-cyclohexane
SpectraBase Compound ID CtfCLjHgX32
InChI InChI=1S/C13H17NO2/c1-13(9-3-2-4-10-13)11-5-7-12(8-6-11)14(15)16/h5-8H,2-4,9-10H2,1H3
InChIKey LLRMVPVMQHZDFT-UHFFFAOYSA-N
Mol Weight 219.28 g/mol
Molecular Formula C13H17NO2
Exact Mass 219.125929 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID yG63NofXxF
Name 1-Methyl-1-(4-nitro-phenyl)-cyclohexane
CAS Registry Number 35172-44-2
Comments CONFORMER A, CFCL3/C6D12 AS SOLVENT
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C13H17NO2
InChI InChI=1S/C13H17NO2/c1-13(9-3-2-4-10-13)11-5-7-12(8-6-11)14(15)16/h5-8H,2-4,9-10H2,1H3
InChIKey LLRMVPVMQHZDFT-UHFFFAOYSA-N
Instrument Name Jeol FX-100
Literature Reference M.J. Cook, K.A. Nasri, Magn. Res. Chem. 25, 644 (1987).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent Mixture