difluoromethyl 3-[3-methyl-1-phenyl-4-(trifluoromethyl)-1H-pyrazolo[3,4-b]pyridin-6-yl]phenyl ether

SpectraBase Compound ID	JPBKaNW4ng2
InChI	InChI=1S/C21H14F5N3O/c1-12-18-16(21(24,25)26)11-17(13-6-5-9-15(10-13)30-20(22)23)27-19(18)29(28-12)14-7-3-2-4-8-14/h2-11,20H,1H3
InChIKey	STUBQOGXMOMCGI-UHFFFAOYSA-N Google Search
Mol Weight	419.36 g/mol
Molecular Formula	C21H14F5N3O
Exact Mass	419.105703 g/mol

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SpectraBase Spectrum ID	LBvln6CnsQL
Name	difluoromethyl 3-[3-methyl-1-phenyl-4-(trifluoromethyl)-1H-pyrazolo[3,4-b]pyridin-6-yl]phenyl ether
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/C21H14F5N3O/c1-12-18-16(21(24,25)26)11-17(13-6-5-9-15(10-13)30-20(22)23)27-19(18)29(28-12)14-7-3-2-4-8-14/h2-11,20H,1H3
InChIKey	STUBQOGXMOMCGI-UHFFFAOYSA-N
NMR Offset	15.328
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_SBI_36227_30722
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: 1724566; SBI_ID: SBI-030726
Synonyms	6-[3-(difluoromethoxy)phenyl]-3-methyl-1-phenyl-4-(trifluoromethyl)-1H-pyrazolo[3,4-b]pyridine
Temperature	318 °C