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4-piperidinone, 1-methyl-3,5-bis[[3-(2-methylpropyl)-1-phenyl-1H-pyrazol-4-yl]methylene]-, (3E,5E)-
SpectraBase Compound ID EwCK1L4JGVs
InChI InChI=1S/C34H39N5O/c1-24(2)16-32-26(22-38(35-32)30-12-8-6-9-13-30)18-28-20-37(5)21-29(34(28)40)19-27-23-39(31-14-10-7-11-15-31)36-33(27)17-25(3)4/h6-15,18-19,22-25H,16-17,20-21H2,1-5H3/b28-18+,29-19+
InChIKey SFHNYEGBZHPFJL-UOSOPFLXSA-N
Mol Weight 533.7 g/mol
Molecular Formula C34H39N5O
Exact Mass 533.315461 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 7dqEbPMSQzj
Name 4-piperidinone, 1-methyl-3,5-bis[[3-(2-methylpropyl)-1-phenyl-1H-pyrazol-4-yl]methylene]-, (3E,5E)-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 533.315460895 u
Formula C34H39N5O
InChI InChI=1S/C34H39N5O/c1-24(2)16-32-26(22-38(35-32)30-12-8-6-9-13-30)18-28-20-37(5)21-29(34(28)40)19-27-23-39(31-14-10-7-11-15-31)36-33(27)17-25(3)4/h6-15,18-19,22-25H,16-17,20-21H2,1-5H3/b28-18+,29-19+
InChIKey SFHNYEGBZHPFJL-UOSOPFLXSA-N
Molecular Weight 533.720 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2021_257
Solvent DMSO-d6
Source Vendor ID: NMR/13238558