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benzoic acid, 4-[[1-oxo-3-[3,4,6-trimethyl-1-(4-methylphenyl)-1H-pyrazolo[3,4-b]pyridin-5-yl]propyl]amino]-, ethyl ester
SpectraBase Compound ID E62VlyIJvUb
InChI InChI=1S/C28H30N4O3/c1-6-35-28(34)21-9-11-22(12-10-21)30-25(33)16-15-24-18(3)26-20(5)31-32(27(26)29-19(24)4)23-13-7-17(2)8-14-23/h7-14H,6,15-16H2,1-5H3,(H,30,33)
InChIKey XSPJEQRTKOAPKN-UHFFFAOYSA-N
Mol Weight 470.57 g/mol
Molecular Formula C28H30N4O3
Exact Mass 470.231791 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID GZ6r1NqzguF
Name benzoic acid, 4-[[1-oxo-3-[3,4,6-trimethyl-1-(4-methylphenyl)-1H-pyrazolo[3,4-b]pyridin-5-yl]propyl]amino]-, ethyl ester
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 470.231790839 u
Formula C28H30N4O3
InChI InChI=1S/C28H30N4O3/c1-6-35-28(34)21-9-11-22(12-10-21)30-25(33)16-15-24-18(3)26-20(5)31-32(27(26)29-19(24)4)23-13-7-17(2)8-14-23/h7-14H,6,15-16H2,1-5H3,(H,30,33)
InChIKey XSPJEQRTKOAPKN-UHFFFAOYSA-N
Molecular Weight 470.573 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2021_6092
Solvent DMSO-d6
Source Vendor ID: NMR/12709581