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1-(4-bromophenyl)-2,5-dioxo-3-pyrrolidinyl N-benzyl-N'-{4-[chloro(difluoro)methoxy]phenyl}imidothiocarbamate
SpectraBase Compound ID I1ysuVzg1WT
InChI InChI=1S/C25H19BrClF2N3O3S/c26-17-6-10-19(11-7-17)32-22(33)14-21(23(32)34)36-24(30-15-16-4-2-1-3-5-16)31-18-8-12-20(13-9-18)35-25(27,28)29/h1-13,21H,14-15H2,(H,30,31)
InChIKey XZRNYNUNNWRGPX-UHFFFAOYSA-N
Mol Weight 594.86 g/mol
Molecular Formula C25H19BrClF2N3O3S
Exact Mass 592.99871 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID Ep2aFzQEWjK
Name 1-(4-bromophenyl)-2,5-dioxo-3-pyrrolidinyl N-benzyl-N'-{4-[chloro(difluoro)methoxy]phenyl}imidothiocarbamate
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/C25H19BrClF2N3O3S/c26-17-6-10-19(11-7-17)32-22(33)14-21(23(32)34)36-24(30-15-16-4-2-1-3-5-16)31-18-8-12-20(13-9-18)35-25(27,28)29/h1-13,21H,14-15H2,(H,30,31)
InChIKey XZRNYNUNNWRGPX-UHFFFAOYSA-N
NMR Offset 16.0087
NMR Spectrometer Frequency 500.133
Observed nucleus 1H
Origin 1H_ASIOH_7529_2025
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/9296181; Labnumber: PE/9043414