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N-{5-[(4-chloro-1H-pyrazol-1-yl)methyl]-2-furoyl}-N'-(4-iodophenyl)thiourea
SpectraBase Compound ID DvvlCTo7Q7z
InChI InChI=1S/C16H12ClIN4O2S/c17-10-7-19-22(8-10)9-13-5-6-14(24-13)15(23)21-16(25)20-12-3-1-11(18)2-4-12/h1-8H,9H2,(H2,20,21,23,25)
InChIKey GLQSMXQABUVBRC-UHFFFAOYSA-N
Mol Weight 486.72 g/mol
Molecular Formula C16H12ClIN4O2S
Exact Mass 485.94142 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 7YIIncruaJ2
Name N-{5-[(4-chloro-1H-pyrazol-1-yl)methyl]-2-furoyl}-N'-(4-iodophenyl)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/C16H12ClIN4O2S/c17-10-7-19-22(8-10)9-13-5-6-14(24-13)15(23)21-16(25)20-12-3-1-11(18)2-4-12/h1-8H,9H2,(H2,20,21,23,25)
InChIKey GLQSMXQABUVBRC-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_6340
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: 9686425; UBI_ID: UBI-006342
Temperature 318 °C