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5-({3-chloro-5-ethoxy-4-[(4-fluorobenzyl)oxy]benzyl}amino)-1,3-dihydro-2H-benzimidazol-2-one
SpectraBase Compound ID 7vPSZ1K6rAF
InChI InChI=1S/C23H21ClFN3O3/c1-2-30-21-10-15(12-26-17-7-8-19-20(11-17)28-23(29)27-19)9-18(24)22(21)31-13-14-3-5-16(25)6-4-14/h3-11,26H,2,12-13H2,1H3,(H2,27,28,29)
InChIKey WWSVXPPYVKSWQZ-UHFFFAOYSA-N
Mol Weight 441.89 g/mol
Molecular Formula C23H21ClFN3O3
Exact Mass 441.125547 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID fJrAQm7aD1
Name 5-({3-chloro-5-ethoxy-4-[(4-fluorobenzyl)oxy]benzyl}amino)-1,3-dihydro-2H-benzimidazol-2-one
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/C23H21ClFN3O3/c1-2-30-21-10-15(12-26-17-7-8-19-20(11-17)28-23(29)27-19)9-18(24)22(21)31-13-14-3-5-16(25)6-4-14/h3-11,26H,2,12-13H2,1H3,(H2,27,28,29)
InChIKey WWSVXPPYVKSWQZ-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_35422
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: E90996; SBI_ID: SBI-035426
Temperature 308 °C