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

*Links on SpectraBase are not permalinks.
1,3-DICHLORO-2-PROPYL-BUTANOATE;N=2
SpectraBase Compound ID JEwPm7S6bKg
InChI InChI=1S/C7H12Cl2O2/c1-2-3-7(10)11-6(4-8)5-9/h6H,2-5H2,1H3
InChIKey CQXQGTMPQPIRLJ-UHFFFAOYSA-N
Mol Weight 199.08 g/mol
Molecular Formula C7H12Cl2O2
Exact Mass 198.021435 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 BzhDrmo28HA
Name 1,3-DICHLORO-2-PROPYL-BUTANOATE;N=2
Compound Number 3A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C7H12Cl2O2
InChI InChI=1S/C7H12Cl2O2/c1-2-3-7(10)11-6(4-8)5-9/h6H,2-5H2,1H3
InChIKey CQXQGTMPQPIRLJ-UHFFFAOYSA-N
Literature Reference Author M.ESCRIBA,M.BARBUT,J.ERAS,R.CANELA,J.AVILLA,.BALCELLS
Literature Reference Citation J.AGR.FOOD.CHEM.,57,4849(2009)
Literature Reference DOI 10.1021/jf900097j
Molecular Weight 199.077 g/mol
Sample ID 67990
Solvent CDCl3