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2-(3-heptyl-5-oxo-1-phenyl-2-thioxo-4-imidazolidinyl)-N-[4-(trifluoromethoxy)phenyl]acetamide
SpectraBase Compound ID 7gaxCIciHoz
InChI InChI=1S/C25H28F3N3O3S/c1-2-3-4-5-9-16-30-21(23(33)31(24(30)35)19-10-7-6-8-11-19)17-22(32)29-18-12-14-20(15-13-18)34-25(26,27)28/h6-8,10-15,21H,2-5,9,16-17H2,1H3,(H,29,32)
InChIKey JWDKPFBJPNGGSQ-UHFFFAOYSA-N
Mol Weight 507.57 g/mol
Molecular Formula C25H28F3N3O3S
Exact Mass 507.180347 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID Gk0U2O1c246
Name 2-(3-heptyl-5-oxo-1-phenyl-2-thioxo-4-imidazolidinyl)-N-[4-(trifluoromethoxy)phenyl]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/C25H28F3N3O3S/c1-2-3-4-5-9-16-30-21(23(33)31(24(30)35)19-10-7-6-8-11-19)17-22(32)29-18-12-14-20(15-13-18)34-25(26,27)28/h6-8,10-15,21H,2-5,9,16-17H2,1H3,(H,29,32)
InChIKey JWDKPFBJPNGGSQ-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_20506
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: D18688; Labnumber: MPOL-15364; SBI_ID: SBI-020510
Temperature 318 °C