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1-(3-chlorobenzyl)-3-nitro-1H-1,2,4-triazole

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1-(3-chlorobenzyl)-3-nitro-1H-1,2,4-triazole
SpectraBase Compound ID HXrQ4UDAZxa
InChI InChI=1S/C9H7ClN4O2/c10-8-3-1-2-7(4-8)5-13-6-11-9(12-13)14(15)16/h1-4,6H,5H2
InChIKey CHWBRWAYQFXOQT-UHFFFAOYSA-N
Mol Weight 238.63 g/mol
Molecular Formula C9H7ClN4O2
Exact Mass 238.025753 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID JK54WOvjJsr
Name 1-(3-chlorobenzyl)-3-nitro-1H-1,2,4-triazole
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/C9H7ClN4O2/c10-8-3-1-2-7(4-8)5-13-6-11-9(12-13)14(15)16/h1-4,6H,5H2
InChIKey CHWBRWAYQFXOQT-UHFFFAOYSA-N
NMR Offset 17.1563
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_9160
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: UZI/1266295; Labnumber: GLA0217; UZI_ID: UZI-009162
Temperature 308 °C