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2-{1-ethyl-5-oxo-3-[2-(2,3,4,5,6-pentachloroanilino)ethyl]-2-thioxo-4-imidazolidinyl}-N-(4-methoxyphenyl)acetamide
SpectraBase Compound ID 85Sg9yt2DoU
InChI InChI=1S/C22H21Cl5N4O3S/c1-3-30-21(33)13(10-14(32)29-11-4-6-12(34-2)7-5-11)31(22(30)35)9-8-28-20-18(26)16(24)15(23)17(25)19(20)27/h4-7,13,28H,3,8-10H2,1-2H3,(H,29,32)
InChIKey RCRQRDKPUUDPPB-UHFFFAOYSA-N
Mol Weight 598.8 g/mol
Molecular Formula C22H21Cl5N4O3S
Exact Mass 595.9777 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 8iUhu4Ksp5x
Name 2-{1-ethyl-5-oxo-3-[2-(2,3,4,5,6-pentachloroanilino)ethyl]-2-thioxo-4-imidazolidinyl}-N-(4-methoxyphenyl)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/C22H21Cl5N4O3S/c1-3-30-21(33)13(10-14(32)29-11-4-6-12(34-2)7-5-11)31(22(30)35)9-8-28-20-18(26)16(24)15(23)17(25)19(20)27/h4-7,13,28H,3,8-10H2,1-2H3,(H,29,32)
InChIKey RCRQRDKPUUDPPB-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_18912
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: D11867; Labnumber: MPOL-16173; SBI_ID: SBI-018915
Temperature 308 °C