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1H-pyrazolo[3,4-b]pyridine, 5-[3-[4-(5-chloro-2-methylphenyl)-1-piperazinyl]-3-oxopropyl]-1-(3,4-dimethylphenyl)-3,4,6-trimethyl-

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1H-pyrazolo[3,4-b]pyridine, 5-[3-[4-(5-chloro-2-methylphenyl)-1-piperazinyl]-3-oxopropyl]-1-(3,4-dimethylphenyl)-3,4,6-trimethyl-
SpectraBase Compound ID CjbwoDMIYsb
InChI InChI=1S/C31H36ClN5O/c1-19-8-10-26(17-21(19)3)37-31-30(24(6)34-37)22(4)27(23(5)33-31)11-12-29(38)36-15-13-35(14-16-36)28-18-25(32)9-7-20(28)2/h7-10,17-18H,11-16H2,1-6H3
InChIKey QBBPIKFJHRKLLW-UHFFFAOYSA-N
Mol Weight 530.1 g/mol
Molecular Formula C31H36ClN5O
Exact Mass 529.260838 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 6CkifwpWPn2
Name 1H-pyrazolo[3,4-b]pyridine, 5-[3-[4-(5-chloro-2-methylphenyl)-1-piperazinyl]-3-oxopropyl]-1-(3,4-dimethylphenyl)-3,4,6-trimethyl-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 529.260838498 u
Formula C31H36ClN5O
InChI InChI=1S/C31H36ClN5O/c1-19-8-10-26(17-21(19)3)37-31-30(24(6)34-37)22(4)27(23(5)33-31)11-12-29(38)36-15-13-35(14-16-36)28-18-25(32)9-7-20(28)2/h7-10,17-18H,11-16H2,1-6H3
InChIKey QBBPIKFJHRKLLW-UHFFFAOYSA-N
Molecular Weight 530.116 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2021_6912
Solvent DMSO-d6
Source Vendor ID: NMR/12718350