2-(4-tert-butylphenyl)-N-[3-(trifluoromethyl)phenyl]-4-quinolinecarboxamide

SpectraBase Compound ID	BCPpE2YKID8
InChI	InChI=1S/C27H23F3N2O/c1-26(2,3)18-13-11-17(12-14-18)24-16-22(21-9-4-5-10-23(21)32-24)25(33)31-20-8-6-7-19(15-20)27(28,29)30/h4-16H,1-3H3,(H,31,33)
InChIKey	NBFNKMJQWUPSOO-UHFFFAOYSA-N Google Search
Mol Weight	448.49 g/mol
Molecular Formula	C27H23F3N2O
Exact Mass	448.176248 g/mol

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SpectraBase Spectrum ID	50p2fyx4AXc
Name	2-(4-tert-butylphenyl)-N-[3-(trifluoromethyl)phenyl]-4-quinolinecarboxamide
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/C27H23F3N2O/c1-26(2,3)18-13-11-17(12-14-18)24-16-22(21-9-4-5-10-23(21)32-24)25(33)31-20-8-6-7-19(15-20)27(28,29)30/h4-16H,1-3H3,(H,31,33)
InChIKey	NBFNKMJQWUPSOO-UHFFFAOYSA-N
NMR Offset	15.3537
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_UBI_21270_10296
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: UZI/9071231; UBI_ID: UBI-010299
Temperature	308 °C