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

*Links on SpectraBase are not permalinks.
2,2,3,4,4-PENTACHLOR-3-BUTENSAEUREBUTYLESTER
SpectraBase Compound ID IcouonPKjr3
InChI InChI=1S/C8H9Cl5O2/c1-2-3-4-15-7(14)8(12,13)5(9)6(10)11/h2-4H2,1H3
InChIKey JZJILZTVTMMGAR-UHFFFAOYSA-N
Mol Weight 314.4 g/mol
Molecular Formula C8H9Cl5O2
Exact Mass 311.904518 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 D3IAHYjHCY2
Name Pentachloro-3-butenoic acid, butyl ester
CAS Registry Number 75147-20-5
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C8H9Cl5O2
InChI InChI=1S/C8H9Cl5O2/c1-2-3-4-15-7(14)8(12,13)5(9)6(10)11/h2-4H2,1H3
InChIKey JZJILZTVTMMGAR-UHFFFAOYSA-N
Instrument Name Bruker HX-90
Literature Reference W. Kimpenhaus, W. Auf Der Heyde, Liebigs Ann. Chem. 378 (1983).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3