For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.

AYNLVCDVIRSLER-UHFFFAOYSA-N

Compound with spectra: 2 NMR

AYNLVCDVIRSLER-UHFFFAOYSA-N
SpectraBase Compound ID 5YC5Da99Vkk
InChI InChI=1S/C6H9IO/c7-5-3-1-2-4-6(5)8/h5H,1-4H2
InChIKey AYNLVCDVIRSLER-UHFFFAOYSA-N
Mol Weight 224.04 g/mol
Molecular Formula C6H9IO
Exact Mass 223.96981 g/mol

View Spectrum of AYNLVCDVIRSLER-UHFFFAOYSA-N

13C NMR Spectrum
Copyright Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.

View Spectrum of AYNLVCDVIRSLER-UHFFFAOYSA-N

13C NMR Spectrum
Copyright Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent CDCl3
  • 2-IODOCYCLOHEXANONE
2-Methyl-cyclohexanonium cation
(2R)-2-hydroxycyclohexanone
2-Bromocyclohexan-1-one
(2S)-2-hydroxycyclohexanone
2-Hydroxycyclohexan-1-one
(2R)-2-BROMOCYCLOHEXANONE
2-Iodanylhexanoic acid
2-Methylcyclopentanone
6-IODO-HEPTANOIC-ACID
N-Butyl cyclopropyl ketone
Title Journal or Book Year
Conformational analysis of 2-halocyclohexanones: an NMR, theoretical and solvation study Journal of the Chemical Society, Perkin Transactions 2 2002

This compound is available in the following databases:

KnowItAll NMR Spectral Library
Author: Wiley

The KnowItAll NMR Spectral Library offers a comprehensive collection of NMR reference spectra, including NMR, CNMR, and XNMR, and covers a wide range of compounds including organics, polymers, monomers, metabolites, and more. Learn more.

Other Resources
Unknown Identification

Search your unknown spectrum against the world's largest collection of reference spectra

KnowItAll Campus Solutions

KnowItAll offers faculty and students at your school access to all the tools you need for spectral analysis and structure drawing & publishing! Plus, access the world's largest spectral library.