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6-bromo-2-{[(6-chloro-1,3-benzodioxol-5-yl)methyl]sulfanyl}-3H-imidazo[4,5-b]pyridine
SpectraBase Compound ID BCjR3JlHrb9
InChI InChI=1S/C14H9BrClN3O2S/c15-8-2-10-13(17-4-8)19-14(18-10)22-5-7-1-11-12(3-9(7)16)21-6-20-11/h1-4H,5-6H2,(H,17,18,19)
InChIKey XCNVJSUJFHLYJU-UHFFFAOYSA-N
Mol Weight 398.66 g/mol
Molecular Formula C14H9BrClN3O2S
Exact Mass 396.928738 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 6oOdWQSwdJO
Name 6-bromo-2-{[(6-chloro-1,3-benzodioxol-5-yl)methyl]sulfanyl}-3H-imidazo[4,5-b]pyridine
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/C14H9BrClN3O2S/c15-8-2-10-13(17-4-8)19-14(18-10)22-5-7-1-11-12(3-9(7)16)21-6-20-11/h1-4H,5-6H2,(H,17,18,19)
InChIKey XCNVJSUJFHLYJU-UHFFFAOYSA-N
NMR Offset 15.0036
NMR Spectrometer Frequency 250.134
Observed nucleus 1H
Origin 1H_ASIOH_7000_500
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: ZI/8121384; Labnumber: SAD-1500085; IOH_ID: IOH-000501
Synonyms 6-bromo-3H-imidazo[4,5-b]pyridin-2-yl (6-chloro-1,3-benzodioxol-5-yl)methyl sulfide
Temperature 297 °C