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

*Links on SpectraBase are not permalinks.
Dimethyl 1,5-(Ethylmethyl)semibullvalene-2,6-dicarboxylate
SpectraBase Compound ID 3ZsiluPnVTz
InChI InChI=1S/C15H18O4/c1-5-15-10-8-9(11(16)18-3)13(15,2)6-7-14(10,15)12(17)19-4/h6-8,10H,5H2,1-4H3/t10-,13-,14+,15+/m0/s1
InChIKey WUFQRUFRXAXAET-BSLXNSKLSA-N
Mol Weight 262.3 g/mol
Molecular Formula C15H18O4
Exact Mass 262.120509 g/mol
Enantiomer InChIKey WUFQRUFRXAXAET-RABLLNBGSA-N
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent CDCl3
Title Journal or Book Year
Lifting of the Degeneracy in Semibullvalenes by Remote and Direct Substituents:  A Quantitative Study Using Variable-Temperature Carbon-13 NMR Spectroscopy The Journal of Organic Chemistry 2001

This compound is available in the following databases:

KnowItAll Mass Spectral Library

Author: Wiley

The KnowItAll Mass Spectral Library offers a comprehensive collection of mass spectra, including the renowned Wiley Registry, and access to a wide range of compounds including pure organics, drugs, steroids, additives, geochemicals, petrochemicals, biomarkers, and more. Learn more.

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.