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cyclohexanone, 2,6-bis[(2-chloro-6-fluorophenyl)methylene]-4-ethyl-, (2E,6E)-
SpectraBase Compound ID KcWwgS1sUtv
InChI InChI=1S/C22H18Cl2F2O/c1-2-13-9-14(11-16-18(23)5-3-7-20(16)25)22(27)15(10-13)12-17-19(24)6-4-8-21(17)26/h3-8,11-13H,2,9-10H2,1H3/b14-11+,15-12+
InChIKey PEDCWDZGOMGIFO-LCPPQYOVSA-N
Mol Weight 407.29 g/mol
Molecular Formula C22H18Cl2F2O
Exact Mass 406.070277 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 4ABCKECzHBs
Name cyclohexanone, 2,6-bis[(2-chloro-6-fluorophenyl)methylene]-4-ethyl-, (2E,6E)-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 406.070276925 u
Formula C22H18Cl2F2O
InChI InChI=1S/C22H18Cl2F2O/c1-2-13-9-14(11-16-18(23)5-3-7-20(16)25)22(27)15(10-13)12-17-19(24)6-4-8-21(17)26/h3-8,11-13H,2,9-10H2,1H3/b14-11+,15-12+
InChIKey PEDCWDZGOMGIFO-LCPPQYOVSA-N
Molecular Weight 407.288 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2021_2318
Solvent DMSO-d6
Source Vendor ID: NMR/13268603