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5-Amino-1-benzyl-1H-[1,2,3]triazole-4-carboxylic acid (4-trifluoromethoxy-phenyl)-amide
SpectraBase Compound ID Dj6AGSa9hbM
InChI InChI=1S/C17H14F3N5O2/c18-17(19,20)27-13-8-6-12(7-9-13)22-16(26)14-15(21)25(24-23-14)10-11-4-2-1-3-5-11/h1-9H,10,21H2,(H,22,26)
InChIKey DUGIYQFGHXKLOI-UHFFFAOYSA-N
Mol Weight 377.33 g/mol
Molecular Formula C17H14F3N5O2
Exact Mass 377.109959 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 1lZ46TVzqGf
Name 1H-1,2,3-triazole-4-carboxamide, 5-amino-1-(phenylmethyl)-N-[4-(trifluoromethoxy)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/C17H14F3N5O2/c18-17(19,20)27-13-8-6-12(7-9-13)22-16(26)14-15(21)25(24-23-14)10-11-4-2-1-3-5-11/h1-9H,10,21H2,(H,22,26)
InChIKey DUGIYQFGHXKLOI-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_ASIOH_8516_7756
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/001831; IOH_ID: IOH-014761