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1H-1,2,3-triazole-4-carboxamide, 5-amino-1-[(4-methoxyphenyl)methyl]-N-[3-(trifluoromethyl)phenyl]-
SpectraBase Compound ID 3RWV0LPc3lg
InChI InChI=1S/C18H16F3N5O2/c1-28-14-7-5-11(6-8-14)10-26-16(22)15(24-25-26)17(27)23-13-4-2-3-12(9-13)18(19,20)21/h2-9H,10,22H2,1H3,(H,23,27)
InChIKey KGPGKKKXFVFOIB-UHFFFAOYSA-N
Mol Weight 391.35 g/mol
Molecular Formula C18H16F3N5O2
Exact Mass 391.125609 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID K8HYAP99U07
Name 1H-1,2,3-triazole-4-carboxamide, 5-amino-1-[(4-methoxyphenyl)methyl]-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/C18H16F3N5O2/c1-28-14-7-5-11(6-8-14)10-26-16(22)15(24-25-26)17(27)23-13-4-2-3-12(9-13)18(19,20)21/h2-9H,10,22H2,1H3,(H,23,27)
InChIKey KGPGKKKXFVFOIB-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_ASIOH_8516_7755
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/001830; IOH_ID: IOH-014760