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N-(2-bromophenyl)-N'-{5-[(4-chloro-1H-pyrazol-1-yl)methyl]-2-furoyl}thiourea
SpectraBase Compound ID BXwwmqRwFnL
InChI InChI=1S/C16H12BrClN4O2S/c17-12-3-1-2-4-13(12)20-16(25)21-15(23)14-6-5-11(24-14)9-22-8-10(18)7-19-22/h1-8H,9H2,(H2,20,21,23,25)
InChIKey YBYOCJSSVPAJNO-UHFFFAOYSA-N
Mol Weight 439.72 g/mol
Molecular Formula C16H12BrClN4O2S
Exact Mass 437.955288 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID CYjyE8yO6HD
Name N-(2-bromophenyl)-N'-{5-[(4-chloro-1H-pyrazol-1-yl)methyl]-2-furoyl}thiourea
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/C16H12BrClN4O2S/c17-12-3-1-2-4-13(12)20-16(25)21-15(23)14-6-5-11(24-14)9-22-8-10(18)7-19-22/h1-8H,9H2,(H2,20,21,23,25)
InChIKey YBYOCJSSVPAJNO-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_6931
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: 9686714; UBI_ID: UBI-006933
Temperature 318 °C