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ethyl 4-[4-[2-(4-chloroanilino)-2-oxoethyl]-3-(4-chlorobenzyl)-5-oxo-2-thioxo-1-imidazolidinyl]benzoate
SpectraBase Compound ID 3zBeKdyXIb9
InChI InChI=1S/C27H23Cl2N3O4S/c1-2-36-26(35)18-5-13-22(14-6-18)32-25(34)23(15-24(33)30-21-11-9-20(29)10-12-21)31(27(32)37)16-17-3-7-19(28)8-4-17/h3-14,23H,2,15-16H2,1H3,(H,30,33)
InChIKey RGQZIEJVASOQML-UHFFFAOYSA-N
Mol Weight 556.46 g/mol
Molecular Formula C27H23Cl2N3O4S
Exact Mass 555.078633 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID JHEmOePmDHV
Name ethyl 4-[4-[2-(4-chloroanilino)-2-oxoethyl]-3-(4-chlorobenzyl)-5-oxo-2-thioxo-1-imidazolidinyl]benzoate
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/C27H23Cl2N3O4S/c1-2-36-26(35)18-5-13-22(14-6-18)32-25(34)23(15-24(33)30-21-11-9-20(29)10-12-21)31(27(32)37)16-17-3-7-19(28)8-4-17/h3-14,23H,2,15-16H2,1H3,(H,30,33)
InChIKey RGQZIEJVASOQML-UHFFFAOYSA-N
NMR Offset 15.3537
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_2078
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: D02288; Labnumber: MPOL-09761; SBI_ID: SBI-002080
Temperature 308 °C