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N-[3,5-bis(trifluoromethyl)phenyl]-2-[(4-hydroxy-6-propyl-2-pyrimidinyl)sulfanyl]acetamide
SpectraBase Compound ID 56V8k714dSR
InChI InChI=1S/C17H15F6N3O2S/c1-2-3-11-7-13(27)26-15(25-11)29-8-14(28)24-12-5-9(16(18,19)20)4-10(6-12)17(21,22)23/h4-7H,2-3,8H2,1H3,(H,24,28)(H,25,26,27)
InChIKey KVAAUHLKGZXVCM-UHFFFAOYSA-N
Mol Weight 439.38 g/mol
Molecular Formula C17H15F6N3O2S
Exact Mass 439.078917 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID AsCJpz3YzmM
Name N-[3,5-bis(trifluoromethyl)phenyl]-2-[(4-hydroxy-6-propyl-2-pyrimidinyl)sulfanyl]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/C17H15F6N3O2S/c1-2-3-11-7-13(27)26-15(25-11)29-8-14(28)24-12-5-9(16(18,19)20)4-10(6-12)17(21,22)23/h4-7H,2-3,8H2,1H3,(H,24,28)(H,25,26,27)
InChIKey KVAAUHLKGZXVCM-UHFFFAOYSA-N
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_24178
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: D47021; Labnumber: KUPS-0513; SBI_ID: SBI-024182
Temperature 306 °C