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

*Links on SpectraBase are not permalinks.
(2R,5S,6R)-5-Benzyl-2-tert-butyl-6-methyl-1,3-dioxan-4-one
SpectraBase Compound ID GcEIEnF4jqJ
InChI InChI=1S/C16H22O3/c1-11-13(10-12-8-6-5-7-9-12)14(17)19-15(18-11)16(2,3)4/h5-9,11,13,15H,10H2,1-4H3/t11-,13+,15-/m1/s1
InChIKey KDBBQEHRROHBOQ-OSAQELSMSA-N
Mol Weight 262.35 g/mol
Molecular Formula C16H22O3
Exact Mass 262.156895 g/mol
Enantiomer InChIKey KDBBQEHRROHBOQ-LNSITVRQSA-N
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Source of Spectrum K-123-2426-41
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent CDCl3
Title Journal or Book Year
( E,R,R )‐5‐Alkyliden‐2‐ tert ‐butyl‐6‐methyl‐1,3‐dioxan‐4‐one: Herstellung aus ( R )‐3‐Hydroxybuttersäure, Cuprat‐Additionen und Hydrolysen zu 3‐Hydroxycarbonsäuren mit chiralen sekundären Alkylgruppen in 2‐Stellung Chemische Berichte 1990

This compound is available in the following databases:

Wiley Registry of Mass Spectral Data 2023

Author: Wiley

The foundation library for any analytical laboratory running mass spectrometry, the Wiley Registry provides the broadest coverage available in any mass spectral library 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.