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

*Links on SpectraBase are not permalinks.
HEPTAKIS-(6-O-HEXYL)-BETA-CYCLODEXTRIN
SpectraBase Compound ID DfBZkRrOZuF
InChI InChI=1S/C84H154O35/c1-8-15-22-29-36-99-43-50-71-57(85)64(92)78(106-50)114-72-51(44-100-37-30-23-16-9-2)108-80(66(94)59(72)87)116-74-53(46-102-39-32-25-18-11-4)110-82(68(96)61(74)89)118-76-55(48-104-41-34-27-20-13-6)112-84(70(98)63(76)91)119-77-56(49-105-42-35-28-21-14-7)111-83(69(97)62(77)90)117-75-54(47-103-40-33-26-19-12-5)109-81(67(95)60(75)88)115-73-52(45-101-38-31-24-17-10-3)107-79(113-71)65(93)58(73)86/h50-98H,8-49H2,1-7H3/t50-,51-,52-,53-,54-,55-,56+,57-,58-,59-,60-,61-,62+,63-,64-,65-,66-,67-,68-,69+,70-,71-,72-,73-,74-,75-,76-,77+,78-,79-,80-,81-,82-,83+,84-/m0/s1
InChIKey JKFHEOVZPAZVMU-ZSTPCQLQSA-N
Mol Weight 1724.1 g/mol
Molecular Formula C84H154O35
Exact Mass 1723.027067 g/mol
Enantiomer InChIKey JKFHEOVZPAZVMU-FHKVRRHQSA-N
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent CDCl3
Title Journal or Book Year
Regioselective Alkylation of β-Cyclodextrin Australian Journal of Chemistry 1998

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.

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.