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N-(4-fluorobenzyl)-1-(4-methoxybenzoyl)-3-(3-pyridinyl)-1H-1,2,4-triazol-5-amine

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N-(4-fluorobenzyl)-1-(4-methoxybenzoyl)-3-(3-pyridinyl)-1H-1,2,4-triazol-5-amine
SpectraBase Compound ID 5PoX3FVjzsg
InChI InChI=1S/C22H18FN5O2/c1-30-19-10-6-16(7-11-19)21(29)28-22(25-13-15-4-8-18(23)9-5-15)26-20(27-28)17-3-2-12-24-14-17/h2-12,14H,13H2,1H3,(H,25,26,27)
InChIKey WPAMWBQSGHMACR-UHFFFAOYSA-N
Mol Weight 403.42 g/mol
Molecular Formula C22H18FN5O2
Exact Mass 403.144453 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID KHFXgmlV27X
Name N-(4-fluorobenzyl)-1-(4-methoxybenzoyl)-3-(3-pyridinyl)-1H-1,2,4-triazol-5-amine
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/C22H18FN5O2/c1-30-19-10-6-16(7-11-19)21(29)28-22(25-13-15-4-8-18(23)9-5-15)26-20(27-28)17-3-2-12-24-14-17/h2-12,14H,13H2,1H3,(H,25,26,27)
InChIKey WPAMWBQSGHMACR-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_35704
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: E91795; SBI_ID: SBI-035708
Synonyms N-(4-fluorobenzyl)-N-[1-(4-methoxybenzoyl)-3-(3-pyridinyl)-1H-1,2,4-triazol-5-yl]amine
Temperature 308 °C