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Cyclohexane
SpectraBase Compound ID 43lA5xR6TdA
InChI InChI=1S/C6H12/c1-2-4-6-5-3-1/h1-6H2
InChIKey XDTMQSROBMDMFD-UHFFFAOYSA-N
Mol Weight 84.16 g/mol
Molecular Formula C6H12
Exact Mass 84.0939 g/mol
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Source of Sample Fisher Scientific Company, Pittsburgh, Pennsylvania
Technique NEAT
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Source of Sample J. T. Baker Chemicals B.V. Deventer (Nl)
Technique Cell
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Source of Sample Fluka
Technique Layer between KBr
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Source of Spectrum SCHOLL
Technique LIQUID, 15 MICROMETERS
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Source of Sample EM SCIENCE
Technique NEAT
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Technique 0.10MM CELL
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Source of Sample The Matheson Company, Inc., East Rutherford, New Jersey
Technique CAPILLARY CELL: NEAT
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Source of Sample Sigma-Aldrich Company Llc.
Source of Spectrum Bio-Rad Laboratories, Inc.
Catalog Number 179191
Technique Neat
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Technique CAPILLARY CELL: NEAT
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Source of Sample Tokyo Kasei Kogyo Company, Ltd., Tokyo, Japan
Solvent CDCl3; Reference=TMS; Temperature 297K
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Source of Sample The Matheson Company, Inc., East Rutherford, New Jersey
Solvent CCl4
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Source of Sample Sigma-Aldrich Co. LLC.
Source of Spectrum Sigma-Aldrich Co. LLC.
Catalog Number 154741
Solvent CDCl3
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Source of Sample Sigma-Aldrich
Source of Spectrum Sigma-Aldrich Co. LLC.
Catalog Number 154741
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Source of Sample Sigma-Aldrich Co. LLC.
Source of Spectrum Sigma-Aldrich Co. LLC.
Catalog Number 154741
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Source of Spectrum Prof. Buback, University of Goettingen, Germany
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Source of Spectrum Prof. Buback, University of Goettingen, Germany
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Source of Sample MCB Manufacturing Chemists, Norwood, Ohio
Solvent Chloroform-d; Reference=TMS Spectrometer= Varian CFT-20
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Solvent CDCl3
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Solvent Neat liquid
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Solvent Neat liquid
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Solvent Neat liquid
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Solvent Benzene-D6
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Solvent CDCl3
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Solvent CDCl3
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Solvent Neat liquid
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Solvent CDCl3
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Solvent C2H2Cl4
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Solvent Benzene-D6
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Solvent Neat liquid
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Solvent Neat liquid
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Solvent Neat liquid
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Solvent Benzene-D6
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Solvent CDCl3
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Solvent CDCl3
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Solvent Neat liquid
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Solvent CDCl3
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Solvent C2H2Cl4
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Solvent Benzene-D6
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Solvent Neat liquid
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Solvent Neat liquid
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Solvent Neat liquid
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Solvent Benzene-D6
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Solvent CDCl3
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Solvent CDCl3
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Solvent Neat liquid
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Solvent CDCl3
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Solvent C2H2Cl4
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Solvent Benzene-D6
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Solvent not reported
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Solvent Neat liquid
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Solvent Neat liquid
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Solvent Neat liquid
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Solvent Benzene-D6
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Solvent CDCl3
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Solvent CDCl3
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Solvent Neat liquid
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Solvent CDCl3
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Solvent C2H2Cl4
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Solvent Benzene-D6
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Solvent Neat liquid
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Solvent Neat liquid
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Solvent Neat liquid
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Solvent Benzene-D6
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Solvent CDCl3
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Solvent CDCl3
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Solvent Neat liquid
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Solvent CDCl3
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Solvent C2H2Cl4
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Solvent Benzene-D6
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Solvent Neat liquid
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Solvent Neat liquid
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Solvent Neat liquid
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Solvent Benzene-D6
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Solvent CDCl3
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Solvent CDCl3
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Solvent Neat liquid
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Solvent CDCl3
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Solvent C2H2Cl4
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Solvent Benzene-D6
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Solvent not reported
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Solvent Neat liquid
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Solvent Neat liquid
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Solvent Neat liquid
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Solvent Benzene-D6
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Solvent CDCl3
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Solvent CDCl3
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Solvent Neat liquid
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Solvent CDCl3
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Solvent C2H2Cl4
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Solvent Benzene-D6
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Solvent Neat liquid
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Solvent Neat liquid
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Solvent Neat liquid
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Solvent Benzene-D6
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Solvent CDCl3
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Solvent CDCl3
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Solvent Neat liquid
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Solvent CDCl3
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Solvent C2H2Cl4
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Solvent Benzene-D6
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Solvent Neat liquid
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Solvent Neat liquid
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Solvent Neat liquid
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Solvent Benzene-D6
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Solvent CDCl3
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Solvent CDCl3
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Solvent Neat liquid
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Solvent CDCl3
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Solvent C2H2Cl4
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Solvent Benzene-D6
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Solvent Neat liquid
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Solvent Neat liquid
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Solvent Neat liquid
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Solvent Benzene-D6
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Solvent CDCl3
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Solvent CDCl3
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Solvent Neat liquid
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Solvent CDCl3
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Solvent C2H2Cl4
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Solvent Benzene-D6
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent NEAT
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Solvent CDCl3
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent CYClOHEXANE-D12
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent C6D6
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent C6D6
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent Unknown
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent CDCl3
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent CDCl3
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent CDCl3
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent ACETONE-D6
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent DMSO-D6
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent C6D6
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent CD3CN
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent CD3OD
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent Unknown
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent DMSO-D6
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent CDCl3
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent CD3OD
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent CDCl3
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Source of Sample Sigma-Aldrich Co. LLC.
Source of Spectrum Sigma-Aldrich Co. LLC.
Catalog Number 154741
Solvent CDCl3
Copyright Copyright © 2023-2024 Wiley-VCH GmbH. All Rights Reserved.
Source of Spectrum H.H.Maurer, M.Meyer, K.Pfleger, A.A. Weber / University of Saarland, D-66424 Homburg Germany
Technique GC/MS
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Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany
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Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany
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Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany
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Source of Spectrum DigiLab GmbH (C) 2024
Technique GC/MS
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Source of Spectrum DigiLab GmbH (C) 2024
Technique GC/MS
Copyright Database Compilation Copyright © 2023-2024 John Wiley and Sons, Inc. Copyright © 2023-2024 John Wiley and Sons, Inc., Portions Copyright Wiley-VCH GmbH, Adams Library under license from Diablo Analytical. All Rights Reserved.
Source of Spectrum Prof. L. Mondello (Chromaleont s.r.l./Univ. Messina, Italy)
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Source of Spectrum HE-1982-0-0
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Source of Spectrum HE-1982-0-0
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Source of Spectrum NW-2245-0-0
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Source of Spectrum SWG-33-1632-0
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Source of Spectrum AA-0-127-1
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Source of Spectrum EP-4998-0-0
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Source of Spectrum AD-0-4575-0
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Source of Spectrum LQ-1992-493-0
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Source of Spectrum SRH-2022-1551-0
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Source of Spectrum SRH-2022-1845-0
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Source of Spectrum SRH-2022-2349-0
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Source of Spectrum SRH-2022-6890-0
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Source of Spectrum US2012296124A1
Copyright Copyright © 2003-2024 John Wiley & Sons, Inc. All Rights Reserved.
Copyright Copyright © 2016-2024 John Wiley & Sons, Inc. All Rights Reserved.
Source of Sample Sigma-Aldrich Company Llc.
Source of Spectrum Bio-Rad Laboratories, Inc.
Catalog Number 179191
Copyright Copyright © 2015-2024 John Wiley & Sons, Inc. All Rights Reserved.
Source of Sample Sigma-Aldrich Company LLC
Source of Spectrum Forensic Spectral Research
Catalog Number 179191
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Catalog Number 154741
Copyright Copyright © 2017-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2017-2024 John Wiley & Sons, Inc. All Rights Reserved.
Catalog Number 179191
Copyright Copyright © 2017-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2017-2024 John Wiley & Sons, Inc. All Rights Reserved.
Catalog Number C100307
Copyright Copyright © 2018-2024 John Wiley & Sons, Inc. All Rights Reserved.
Source of Sample Sigma Aldrich Company LLC.
Source of Spectrum Bio-Rad Laboratories, Inc.
Catalog Number 179191
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Copyright Copyright © 2018-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2018-2024 John Wiley & Sons, Inc. All Rights Reserved.
Source of Sample Sigma-Aldrich
Catalog Number C100307
  • Hexamethylene
  • Hexahydrobenzene
  • Hexanaphthene
  • CYCLOHEXAN
  • CYCLOHEXANE;LITERATURE
  • CYCLOHEXAN-1,2-DIOL, cis
  • Benzene <hexahydro->
  • Cyclohexane-d12
  • Cyclohexane-1,2-diol
  • Cyclohexane, 1,2,3,4,5,6-hexadeutero-
Title Journal or Book Year
Influence of the spatial position of a trifluoromethyl group on the13C chemical shifts in the cyclohexane series Magnetic Resonance in Chemistry 2006
1H and13C NMR data to aid the identification and quantification of residual solvents by NMR spectroscopy Magnetic Resonance in Chemistry 2005
The conformational behaviour of methylenecyclohexanes revisited Canadian Journal of Chemistry 2003
NMR Chemical Shifts of Common Laboratory Solvents as Trace Impurities The Journal of Organic Chemistry 1997
Assignment of the configuration of a substituent in saturated six-membered ring compounds using the13C chemical shifts of a single epimer Magnetic Resonance in Chemistry 1993
13C-NMR studies of polyfluorinated hydrocarbons, carboxylic acid derivatives, alcohols and ethers Journal of Fluorine Chemistry 1981
Nature of substituent effects in nuclear magnetic resonance spectroscopy. 1. Factor analysis of carbon-13 chemical shifts in aliphatic halides The Journal of Organic Chemistry 1980
Vergleichende Kernresonanz‐Untersuchungen an Makrocyclen und einem Catenan Chemische Berichte 1976
Application of carbon-13 nuclear magnetic resonance spectroscopy to the analysis of charge distribution patterns in unsaturated carbonyl-containing compounds Journal of the American Chemical Society 1976
Deuterium-isotopieeffekte auf die 13C-chemischen verschiebungen und kohlenstoff-deuterium kopplungskonstanten in deuterierten verbindungen Tetrahedron 1973

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Unknown Identification

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