1H-pyrazolo[3,4-b]pyridine-1-acetic acid, 3-cyclopropyl-6-(3,4-dimethylphenyl)-4-(trifluoromethyl)-, ethyl ester

SpectraBase Compound ID	BOPI3RPT4Sx
InChI	InChI=1S/C22H22F3N3O2/c1-4-30-18(29)11-28-21-19(20(27-28)14-7-8-14)16(22(23,24)25)10-17(26-21)15-6-5-12(2)13(3)9-15/h5-6,9-10,14H,4,7-8,11H2,1-3H3
InChIKey	ZFAPROYXNWAJFQ-UHFFFAOYSA-N Google Search
Mol Weight	417.43 g/mol
Molecular Formula	C22H22F3N3O2
Exact Mass	417.166411 g/mol

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SpectraBase Spectrum ID	2ZEF4Jau2gY
Name	1H-pyrazolo[3,4-b]pyridine-1-acetic acid, 3-cyclopropyl-6-(3,4-dimethylphenyl)-4-(trifluoromethyl)-, ethyl ester
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/C22H22F3N3O2/c1-4-30-18(29)11-28-21-19(20(27-28)14-7-8-14)16(22(23,24)25)10-17(26-21)15-6-5-12(2)13(3)9-15/h5-6,9-10,14H,4,7-8,11H2,1-3H3
InChIKey	ZFAPROYXNWAJFQ-UHFFFAOYSA-N
NMR Offset	15.449
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_UZI_26187_22962
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: 2256474; UZI_ID: UZI-022970
Temperature	308 °C