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1H-pyrrole-2,4-dicarboxylic acid, 3-amino-1-[3-(trifluoromethyl)phenyl]-, diethyl ester
SpectraBase Compound ID I3gjllXpW7X
InChI InChI=1S/C17H17F3N2O4/c1-3-25-15(23)12-9-22(14(13(12)21)16(24)26-4-2)11-7-5-6-10(8-11)17(18,19)20/h5-9H,3-4,21H2,1-2H3
InChIKey ZLUKPLULPZUPHH-UHFFFAOYSA-N
Mol Weight 370.33 g/mol
Molecular Formula C17H17F3N2O4
Exact Mass 370.114042 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 9qyZOZs9s1G
Name 1H-pyrrole-2,4-dicarboxylic acid, 3-amino-1-[3-(trifluoromethyl)phenyl]-, diethyl 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/C17H17F3N2O4/c1-3-25-15(23)12-9-22(14(13(12)21)16(24)26-4-2)11-7-5-6-10(8-11)17(18,19)20/h5-9H,3-4,21H2,1-2H3
InChIKey ZLUKPLULPZUPHH-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_ASIOH_7529_5964
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: NMR/17311942; Labnumber: DUD-0000022