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4-pyrimidinecarboxamide, 5-chloro-2-(ethylthio)-N-[2-(trifluoromethyl)phenyl]-
SpectraBase Compound ID FzK48QtFJFO
InChI InChI=1S/C14H11ClF3N3OS/c1-2-23-13-19-7-9(15)11(21-13)12(22)20-10-6-4-3-5-8(10)14(16,17)18/h3-7H,2H2,1H3,(H,20,22)
InChIKey HJEOXAYYVGXFEF-UHFFFAOYSA-N
Mol Weight 361.77 g/mol
Molecular Formula C14H11ClF3N3OS
Exact Mass 361.026345 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 6PAIEdPRwos
Name 4-pyrimidinecarboxamide, 5-chloro-2-(ethylthio)-N-[2-(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/C14H11ClF3N3OS/c1-2-23-13-19-7-9(15)11(21-13)12(22)20-10-6-4-3-5-8(10)14(16,17)18/h3-7H,2H2,1H3,(H,20,22)
InChIKey HJEOXAYYVGXFEF-UHFFFAOYSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_11628_1649
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: F12073; Labnumber: GOR-S1139-0360