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N-[4-(4-chlorophenoxy)phenyl]-2-[(5-nitro-1H-benzimidazol-2-yl)sulfanyl]acetamide
SpectraBase Compound ID CUiU73sQZHE
InChI InChI=1S/C21H15ClN4O4S/c22-13-1-6-16(7-2-13)30-17-8-3-14(4-9-17)23-20(27)12-31-21-24-18-10-5-15(26(28)29)11-19(18)25-21/h1-11H,12H2,(H,23,27)(H,24,25)
InChIKey BIKYLZKGRPITPY-UHFFFAOYSA-N
Mol Weight 454.89 g/mol
Molecular Formula C21H15ClN4O4S
Exact Mass 454.050254 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 2bkz4r5AI1U
Name N-[4-(4-chlorophenoxy)phenyl]-2-[(5-nitro-1H-benzimidazol-2-yl)sulfanyl]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/C21H15ClN4O4S/c22-13-1-6-16(7-2-13)30-17-8-3-14(4-9-17)23-20(27)12-31-21-24-18-10-5-15(26(28)29)11-19(18)25-21/h1-11H,12H2,(H,23,27)(H,24,25)
InChIKey BIKYLZKGRPITPY-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_18243
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: UZI/9372009; Labnumber: TQ00147; UZI_ID: UZI-018250
Temperature 308 °C