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

*Links on SpectraBase are not permalinks.
DIMETHYL-(E)-HEX-2-EN-4-YNE-1,6-DIOATE
SpectraBase Compound ID 1bGJv7qDnZI
InChI InChI=1S/C8H8O4/c1-11-7(9)5-3-4-6-8(10)12-2/h3,5H,1-2H3/b5-3+
InChIKey UNECWDPVPISMJL-HWKANZROSA-N
Mol Weight 168.15 g/mol
Molecular Formula C8H8O4
Exact Mass 168.042259 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID IKk8wSagQ0f
Name DIMETHYL-(E)-HEX-2-EN-4-YNE-1,6-DIOATE
Compound Number 8
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C8H8O4
InChI InChI=1S/C8H8O4/c1-11-7(9)5-3-4-6-8(10)12-2/h3,5H,1-2H3/b5-3+
InChIKey UNECWDPVPISMJL-HWKANZROSA-N
Literature Reference Author C.S.BARRY,J.D.ELSWORTH,P.T.SEDEN,N.BUSHBY,J.R.HARDING,R.W.AL DER,C.L.WILLIS
Literature Reference Citation ORG.LETTERS,8,3319(2006)
Literature Reference DOI 10.1021/ol0611705
Molecular Weight 168.149 g/mol
Sample ID 60750
Solvent CDCl3