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N-(5-chloro-2-pyridinyl)-5-methyl-4-{[3-(trifluoromethyl)phenoxy]methyl}-3-isoxazolecarboxamide
SpectraBase Compound ID 7WFJLWdOtGz
InChI InChI=1S/C18H13ClF3N3O3/c1-10-14(9-27-13-4-2-3-11(7-13)18(20,21)22)16(25-28-10)17(26)24-15-6-5-12(19)8-23-15/h2-8H,9H2,1H3,(H,23,24,26)
InChIKey VVNNAZCDCAFPIE-UHFFFAOYSA-N
Mol Weight 411.77 g/mol
Molecular Formula C18H13ClF3N3O3
Exact Mass 411.059753 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 4cjggolqTKA
Name N-(5-chloro-2-pyridinyl)-5-methyl-4-{[3-(trifluoromethyl)phenoxy]methyl}-3-isoxazolecarboxamide
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/C18H13ClF3N3O3/c1-10-14(9-27-13-4-2-3-11(7-13)18(20,21)22)16(25-28-10)17(26)24-15-6-5-12(19)8-23-15/h2-8H,9H2,1H3,(H,23,24,26)
InChIKey VVNNAZCDCAFPIE-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_32008
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: 1844461; SBI_ID: SBI-032012
Temperature 318 °C