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benzoic acid, 4-[4-(difluoromethyl)-6-(4-methoxyphenyl)-3-methyl-1H-pyrazolo[3,4-b]pyridin-1-yl]-
SpectraBase Compound ID 3jtQf97x2hg
InChI InChI=1S/C22H17F2N3O3/c1-12-19-17(20(23)24)11-18(13-5-9-16(30-2)10-6-13)25-21(19)27(26-12)15-7-3-14(4-8-15)22(28)29/h3-11,20H,1-2H3,(H,28,29)
InChIKey OWBDVJYPUNCZRS-UHFFFAOYSA-N
Mol Weight 409.39 g/mol
Molecular Formula C22H17F2N3O3
Exact Mass 409.123798 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID FY30ojZOBjj
Name benzoic acid, 4-[4-(difluoromethyl)-6-(4-methoxyphenyl)-3-methyl-1H-pyrazolo[3,4-b]pyridin-1-yl]-
Author A.V.Yarkov, IPAC, Russia
Copyright Copyright © 2016-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2021 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C22H17F2N3O3/c1-12-19-17(20(23)24)11-18(13-5-9-16(30-2)10-6-13)25-21(19)27(26-12)15-7-3-14(4-8-15)22(28)29/h3-11,20H,1-2H3,(H,28,29)
InChIKey OWBDVJYPUNCZRS-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_22930
Owner Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State soluted
Solvent DMSO-d6
Source File Reference VendorID: 2253952; UZI_ID: UZI-022938
Temperature 308 °C