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(3E,5E)-1-benzyl-3,5-bis(2-methoxybenzylidene)-4-piperidinone
SpectraBase Compound ID BH3bB0eFDZ9
InChI InChI=1S/C28H27NO3/c1-31-26-14-8-6-12-22(26)16-24-19-29(18-21-10-4-3-5-11-21)20-25(28(24)30)17-23-13-7-9-15-27(23)32-2/h3-17H,18-20H2,1-2H3/b24-16+,25-17+
InChIKey QETQTKNXDBHZSW-MUPYBJATSA-N
Mol Weight 425.53 g/mol
Molecular Formula C28H27NO3
Exact Mass 425.199094 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 6cPpThH6S2W
Name (3E,5E)-1-benzyl-3,5-bis(2-methoxybenzylidene)-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 425.199093730 u
Formula C28H27NO3
InChI InChI=1S/C28H27NO3/c1-31-26-14-8-6-12-22(26)16-24-19-29(18-21-10-4-3-5-11-21)20-25(28(24)30)17-23-13-7-9-15-27(23)32-2/h3-17H,18-20H2,1-2H3/b24-16+,25-17+
InChIKey QETQTKNXDBHZSW-MUPYBJATSA-N
Molecular Weight 425.528 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2020_3958
Solvent DMSO-d6
Source Vendor ID: NMR/12308558