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1H-pyrazole-4-carboxamide, 5-amino-1-(2-cyanoethyl)-N-[3-(trifluoromethyl)phenyl]-
SpectraBase Compound ID 7Lv4Xn3lexC
InChI InChI=1S/C14H12F3N5O/c15-14(16,17)9-3-1-4-10(7-9)21-13(23)11-8-20-22(12(11)19)6-2-5-18/h1,3-4,7-8H,2,6,19H2,(H,21,23)
InChIKey MAIRSGZKKBNJKM-UHFFFAOYSA-N
Mol Weight 323.28 g/mol
Molecular Formula C14H12F3N5O
Exact Mass 323.099395 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID GM9O6pXoXY8
Name 1H-pyrazole-4-carboxamide, 5-amino-1-(2-cyanoethyl)-N-[3-(trifluoromethyl)phenyl]-
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/C14H12F3N5O/c15-14(16,17)9-3-1-4-10(7-9)21-13(23)11-8-20-22(12(11)19)6-2-5-18/h1,3-4,7-8H,2,6,19H2,(H,21,23)
InChIKey MAIRSGZKKBNJKM-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_ASIOH_8516_7750
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/001825; IOH_ID: IOH-014755