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2-{[4-tert-butyl-6-(trifluoromethyl)-2-pyrimidinyl]sulfanyl}-N-(5-chloro-2-methoxyphenyl)acetamide
SpectraBase Compound ID KGTZIJRf1JP
InChI InChI=1S/C18H19ClF3N3O2S/c1-17(2,3)13-8-14(18(20,21)22)25-16(24-13)28-9-15(26)23-11-7-10(19)5-6-12(11)27-4/h5-8H,9H2,1-4H3,(H,23,26)
InChIKey WCDWEXKDXFDUHO-UHFFFAOYSA-N
Mol Weight 433.88 g/mol
Molecular Formula C18H19ClF3N3O2S
Exact Mass 433.08386 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 528qJeCxHh7
Name 2-{[4-tert-butyl-6-(trifluoromethyl)-2-pyrimidinyl]sulfanyl}-N-(5-chloro-2-methoxyphenyl)acetamide
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/C18H19ClF3N3O2S/c1-17(2,3)13-8-14(18(20,21)22)25-16(24-13)28-9-15(26)23-11-7-10(19)5-6-12(11)27-4/h5-8H,9H2,1-4H3,(H,23,26)
InChIKey WCDWEXKDXFDUHO-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_1641
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: UZI/1007921; UBI_ID: UBI-001642
Temperature 308 °C