3-quinolinecarboxylic acid, 4-[(3-carboxy-4-hydroxyphenyl)amino]-7-(trifluoromethyl)-, ethyl ester

SpectraBase Compound ID	CfTYblTjuGk
InChI	InChI=1S/C20H15F3N2O5/c1-2-30-19(29)14-9-24-15-7-10(20(21,22)23)3-5-12(15)17(14)25-11-4-6-16(26)13(8-11)18(27)28/h3-9,26H,2H2,1H3,(H,24,25)(H,27,28)
InChIKey	OXFJRRHVGGMKKH-UHFFFAOYSA-N Google Search
Mol Weight	420.34 g/mol
Molecular Formula	C20H15F3N2O5
Exact Mass	420.093306 g/mol

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SpectraBase Spectrum ID	C7McDkzyBGD
Name	3-quinolinecarboxylic acid, 4-[(3-carboxy-4-hydroxyphenyl)amino]-7-(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/C20H15F3N2O5/c1-2-30-19(29)14-9-24-15-7-10(20(21,22)23)3-5-12(15)17(14)25-11-4-6-16(26)13(8-11)18(27)28/h3-9,26H,2H2,1H3,(H,24,25)(H,27,28)
InChIKey	OXFJRRHVGGMKKH-UHFFFAOYSA-N
NMR Offset	15.5012
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_SBI_11628_549
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: F04453; Labnumber: OVCHIN-00272