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4-imidazolidineacetamide, 3-(1,3-benzodioxol-5-ylmethyl)-1-methyl-5-oxo-2-thioxo-N-[4-(trifluoromethoxy)phenyl]-
SpectraBase Compound ID 88RgETg4dtZ
InChI InChI=1S/C21H18F3N3O5S/c1-26-19(29)15(9-18(28)25-13-3-5-14(6-4-13)32-21(22,23)24)27(20(26)33)10-12-2-7-16-17(8-12)31-11-30-16/h2-8,15H,9-11H2,1H3,(H,25,28)
InChIKey NFILULKRWCIGPK-UHFFFAOYSA-N
Mol Weight 481.45 g/mol
Molecular Formula C21H18F3N3O5S
Exact Mass 481.091926 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 7tbnyH39X33
Name 4-imidazolidineacetamide, 3-(1,3-benzodioxol-5-ylmethyl)-1-methyl-5-oxo-2-thioxo-N-[4-(trifluoromethoxy)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/C21H18F3N3O5S/c1-26-19(29)15(9-18(28)25-13-3-5-14(6-4-13)32-21(22,23)24)27(20(26)33)10-12-2-7-16-17(8-12)31-11-30-16/h2-8,15H,9-11H2,1H3,(H,25,28)
InChIKey NFILULKRWCIGPK-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB3_9000_3158
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: NMR/11278798