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N-(4-methylphenyl)-4-{[4-phenyl-6-(trifluoromethyl)-2-pyrimidinyl]sulfanyl}butanamide
SpectraBase Compound ID DoxGfU0mFZD
InChI InChI=1S/C22H20F3N3OS/c1-15-9-11-17(12-10-15)26-20(29)8-5-13-30-21-27-18(16-6-3-2-4-7-16)14-19(28-21)22(23,24)25/h2-4,6-7,9-12,14H,5,8,13H2,1H3,(H,26,29)
InChIKey HZPMXZJUNHJDOZ-UHFFFAOYSA-N
Mol Weight 431.48 g/mol
Molecular Formula C22H20F3N3OS
Exact Mass 431.127918 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 4iHI9DnDHNb
Name N-(4-methylphenyl)-4-{[4-phenyl-6-(trifluoromethyl)-2-pyrimidinyl]sulfanyl}butanamide
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/C22H20F3N3OS/c1-15-9-11-17(12-10-15)26-20(29)8-5-13-30-21-27-18(16-6-3-2-4-7-16)14-19(28-21)22(23,24)25/h2-4,6-7,9-12,14H,5,8,13H2,1H3,(H,26,29)
InChIKey HZPMXZJUNHJDOZ-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_9393
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/1015972; Labnumber: IDA3340; UZI_ID: UZI-009395
Temperature 318 °C