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3-[(4-chloro-1H-pyrazol-1-yl)methyl]-4-methoxybenzaldehyde thiosemicarbazone
SpectraBase Compound ID 48UQj6dv9fM
InChI InChI=1S/C13H14ClN5OS/c1-20-12-3-2-9(5-16-18-13(15)21)4-10(12)7-19-8-11(14)6-17-19/h2-6,8H,7H2,1H3,(H3,15,18,21)/b16-5+
InChIKey RRNJZCUMNMNVQQ-FZSIALSZSA-N
Mol Weight 323.8 g/mol
Molecular Formula C13H14ClN5OS
Exact Mass 323.060759 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID EZcGDdxqLN7
Name 3-[(4-chloro-1H-pyrazol-1-yl)methyl]-4-methoxybenzaldehyde thiosemicarbazone
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/C13H14ClN5OS/c1-20-12-3-2-9(5-16-18-13(15)21)4-10(12)7-19-8-11(14)6-17-19/h2-6,8H,7H2,1H3,(H3,15,18,21)/b16-5+
InChIKey RRNJZCUMNMNVQQ-FZSIALSZSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_33707
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: 1996398; SBI_ID: SBI-033711
Temperature 318 °C