benzoic acid, 4-[4-(difluoromethyl)-6-(1-ethyl-3-methyl-1H-pyrazol-4-yl)-3-methyl-1H-pyrazolo[3,4-b]pyridin-1-yl]-

SpectraBase Compound ID	DpeInMd1Q4p
InChI	InChI=1S/C21H19F2N5O2/c1-4-27-10-16(11(2)25-27)17-9-15(19(22)23)18-12(3)26-28(20(18)24-17)14-7-5-13(6-8-14)21(29)30/h5-10,19H,4H2,1-3H3,(H,29,30)
InChIKey	VIDYUULNZHTHDC-UHFFFAOYSA-N Google Search
Mol Weight	411.41 g/mol
Molecular Formula	C21H19F2N5O2
Exact Mass	411.150681 g/mol

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SpectraBase Spectrum ID	9u0qNaRujv7
Name	benzoic acid, 4-[4-(difluoromethyl)-6-(1-ethyl-3-methyl-1H-pyrazol-4-yl)-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/C21H19F2N5O2/c1-4-27-10-16(11(2)25-27)17-9-15(19(22)23)18-12(3)26-28(20(18)24-17)14-7-5-13(6-8-14)21(29)30/h5-10,19H,4H2,1-3H3,(H,29,30)
InChIKey	VIDYUULNZHTHDC-UHFFFAOYSA-N
NMR Offset	15.449
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_UZI_26187_22739
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: 2237802; UZI_ID: UZI-022747
Temperature	308 °C