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

*Links on SpectraBase are not permalinks.

Ethyl (E)-3-(4-chlorophenyl)imino-3-perfluorohexylpropanoate

View entire compound with spectra: 2 NMR

Ethyl (E)-3-(4-chlorophenyl)imino-3-perfluorohexylpropanoate
SpectraBase Compound ID ImGYLUM7tAL
InChI InChI=1S/C17H11ClF13NO2/c1-2-34-11(33)7-10(32-9-5-3-8(18)4-6-9)12(19,20)13(21,22)14(23,24)15(25,26)16(27,28)17(29,30)31/h3-6H,2,7H2,1H3/b32-10+
InChIKey HDYZSAZJFMUACA-INRUPRTJSA-N
Mol Weight 543.71 g/mol
Molecular Formula C17H11ClF13NO2
Exact Mass 543.027072 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

Subscribe to view the full spectrum.

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

SpectraBase Spectrum ID JJTirdiStSG
Name Ethyl (E)-3-(4-chlorophenyl)imino-3-perfluorohexylpropanoate
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 543.027072415 u
Formula C17H11ClF13NO2
InChI InChI=1S/C17H11ClF13NO2/c1-2-34-11(33)7-10(32-9-5-3-8(18)4-6-9)12(19,20)13(21,22)14(23,24)15(25,26)16(27,28)17(29,30)31/h3-6H,2,7H2,1H3/b32-10+
InChIKey HDYZSAZJFMUACA-INRUPRTJSA-N
Molecular Weight 543.712 g/mol
SMILES C(OCC)(=O)C\C(=N/c1ccc(cc1)Cl)C(C(C(F)(F)C(F)(F)C(C(F)(F)F)(F)F)(F)F)(F)F