4-[2-[2-methyl-5-(trifluoromethoxy)-1H-indol-3-yl]ethylcarbamoyl]benzoic acid methyl ester

SpectraBase Compound ID	1KSZMbd5toj
InChI	InChI=1S/C21H19F3N2O4/c1-12-16(17-11-15(30-21(22,23)24)7-8-18(17)26-12)9-10-25-19(27)13-3-5-14(6-4-13)20(28)29-2/h3-8,11,26H,9-10H2,1-2H3,(H,25,27)
InChIKey	KPBMRVUSFQZPJF-UHFFFAOYSA-N Google Search
Mol Weight	420.39 g/mol
Molecular Formula	C21H19F3N2O4
Exact Mass	420.129692 g/mol

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SpectraBase Spectrum ID	BfP4x3UjzTI
Name	benzoic acid, 4-[[[2-[2-methyl-5-(trifluoromethoxy)-1H-indol-3-yl]ethyl]amino]carbonyl]-, methyl ester
Author	A.V.Yarkov, IPAC, Russia
Copyright	Copyright © 2016-2025 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2025 John Wiley & Sons, Inc. All Rights Reserved.
InChI	InChI=1S/C21H19F3N2O4/c1-12-16(17-11-15(30-21(22,23)24)7-8-18(17)26-12)9-10-25-19(27)13-3-5-14(6-4-13)20(28)29-2/h3-8,11,26H,9-10H2,1-2H3,(H,25,27)
InChIKey	KPBMRVUSFQZPJF-UHFFFAOYSA-N
NMR Offset	18.0068
NMR Spectrometer Frequency	500.134
Observed nucleus	1H
Origin	1H_ASIOH_8516_8014
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: ZERO/003263; IOH_ID: IOH-015019