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8-azabicyclo[3.2.1]octan-3-one, 2,4-bis[(2-chloro-6-fluorophenyl)methylene]-8-methyl-, (2E,4E)-
SpectraBase Compound ID A1Ys2feKDVo
InChI InChI=1S/C22H17Cl2F2NO/c1-27-20-8-9-21(27)15(11-13-17(24)5-3-7-19(13)26)22(28)14(20)10-12-16(23)4-2-6-18(12)25/h2-7,10-11,20-21H,8-9H2,1H3/b14-10+,15-11+/t20-,21?/m0/s1
InChIKey CZDZRUVLGMBELS-XQKRDUBKSA-N
Mol Weight 420.29 g/mol
Molecular Formula C22H17Cl2F2NO
Exact Mass 419.065526 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID ATGp6ypyOVE
Name 8-azabicyclo[3.2.1]octan-3-one, 2,4-bis[(2-chloro-6-fluorophenyl)methylene]-8-methyl-, (2E,4E)-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 419.065525896 u
Formula C22H17Cl2F2NO
InChI InChI=1S/C22H17Cl2F2NO/c1-27-20-8-9-21(27)15(11-13-17(24)5-3-7-19(13)26)22(28)14(20)10-12-16(23)4-2-6-18(12)25/h2-7,10-11,20-21H,8-9H2,1H3/b14-10+,15-11+/t20-,21?/m0/s1
InChIKey CZDZRUVLGMBELS-XQKRDUBKSA-N
Molecular Weight 420.287 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2021_6249
Solvent DMSO-d6
Source Vendor ID: NMR/13289402