(1-{2-oxo-2-[4-(trifluoromethyl)anilino]ethyl}cyclopentyl)acetic acid

SpectraBase Compound ID	IDmJwT9d9Wu
InChI	InChI=1S/C16H18F3NO3/c17-16(18,19)11-3-5-12(6-4-11)20-13(21)9-15(10-14(22)23)7-1-2-8-15/h3-6H,1-2,7-10H2,(H,20,21)(H,22,23)
InChIKey	HRJNUKJWFNXOCP-UHFFFAOYSA-N Google Search
Mol Weight	329.32 g/mol
Molecular Formula	C16H18F3NO3
Exact Mass	329.123878 g/mol

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SpectraBase Spectrum ID	2A1Yfd4xaSP
Name	(1-{2-oxo-2-[4-(trifluoromethyl)anilino]ethyl}cyclopentyl)acetic acid
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/C16H18F3NO3/c17-16(18,19)11-3-5-12(6-4-11)20-13(21)9-15(10-14(22)23)7-1-2-8-15/h3-6H,1-2,7-10H2,(H,20,21)(H,22,23)
InChIKey	HRJNUKJWFNXOCP-UHFFFAOYSA-N
NMR Offset	15.328
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_SBI_36227_3445
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: D11509; Labnumber: ExPavl-0556; SBI_ID: SBI-003447
Temperature	318 °C