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4-{[(1-benzyl-1H-imidazol-2-yl)sulfanyl]methyl}benzoic acid
SpectraBase Compound ID R78bhcvuAw
InChI InChI=1S/C18H16N2O2S/c21-17(22)16-8-6-15(7-9-16)13-23-18-19-10-11-20(18)12-14-4-2-1-3-5-14/h1-11H,12-13H2,(H,21,22)
InChIKey WYBXRRLOUWFKRI-UHFFFAOYSA-N
Mol Weight 324.4 g/mol
Molecular Formula C18H16N2O2S
Exact Mass 324.093249 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID sKKoQSEkZP
Name 4-{[(1-benzyl-1H-imidazol-2-yl)sulfanyl]methyl}benzoic acid
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/C18H16N2O2S/c21-17(22)16-8-6-15(7-9-16)13-23-18-19-10-11-20(18)12-14-4-2-1-3-5-14/h1-11H,12-13H2,(H,21,22)
InChIKey WYBXRRLOUWFKRI-UHFFFAOYSA-N
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_ASIOH_7529_1180
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/9233457; Labnumber: LP-2190450
Temperature 303 °C