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(3E,5E)-1-benzyl-3,5-bis(2-fluorobenzylidene)-4-piperidinone
SpectraBase Compound ID 3zeFMxEnS9I
InChI InChI=1S/C26H21F2NO/c27-24-12-6-4-10-20(24)14-22-17-29(16-19-8-2-1-3-9-19)18-23(26(22)30)15-21-11-5-7-13-25(21)28/h1-15H,16-18H2/b22-14+,23-15+
InChIKey NBLWDYKFYQMYCS-HOFJZWJUSA-N
Mol Weight 401.46 g/mol
Molecular Formula C26H21F2NO
Exact Mass 401.159121 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 5NMLUG0BtpF
Name (3E,5E)-1-benzyl-3,5-bis(2-fluorobenzylidene)-4-piperidinone
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 401.159120625 u
Formula C26H21F2NO
InChI InChI=1S/C26H21F2NO/c27-24-12-6-4-10-20(24)14-22-17-29(16-19-8-2-1-3-9-19)18-23(26(22)30)15-21-11-5-7-13-25(21)28/h1-15H,16-18H2/b22-14+,23-15+
InChIKey NBLWDYKFYQMYCS-HOFJZWJUSA-N
Molecular Weight 401.457 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2020_3200
Solvent DMSO-d6
Source Vendor ID: NMR/12288594