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1H-pyrazole-3,5-dicarboxylic acid, 4-amino-1-[3-(trifluoromethyl)phenyl]-, diethyl ester
SpectraBase Compound ID yRABABorAI
InChI InChI=1S/C16H16F3N3O4/c1-3-25-14(23)12-11(20)13(15(24)26-4-2)22(21-12)10-7-5-6-9(8-10)16(17,18)19/h5-8H,3-4,20H2,1-2H3
InChIKey LFBGHJURGWYRJN-UHFFFAOYSA-N
Mol Weight 371.32 g/mol
Molecular Formula C16H16F3N3O4
Exact Mass 371.10929 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID AjAFhlnu4Jc
Name 1H-pyrazole-3,5-dicarboxylic acid, 4-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/C16H16F3N3O4/c1-3-25-14(23)12-11(20)13(15(24)26-4-2)22(21-12)10-7-5-6-9(8-10)16(17,18)19/h5-8H,3-4,20H2,1-2H3
InChIKey LFBGHJURGWYRJN-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_ASIOH_7529_6096
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/18211276; Labnumber: DUD-0000003