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1-(3-chloro-4-methyl-5-nitrophenyl)-1H-tetraazole

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1-(3-chloro-4-methyl-5-nitrophenyl)-1H-tetraazole
SpectraBase Compound ID 4DXoNWpl6vR
InChI InChI=1S/C8H6ClN5O2/c1-5-7(9)2-6(3-8(5)14(15)16)13-4-10-11-12-13/h2-4H,1H3
InChIKey AXJNEWFTODEYNN-UHFFFAOYSA-N
Mol Weight 239.62 g/mol
Molecular Formula C8H6ClN5O2
Exact Mass 239.021002 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 1lJngzmTjej
Name 1-(3-chloro-4-methyl-5-nitrophenyl)-1H-tetraazole
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/C8H6ClN5O2/c1-5-7(9)2-6(3-8(5)14(15)16)13-4-10-11-12-13/h2-4H,1H3
InChIKey AXJNEWFTODEYNN-UHFFFAOYSA-N
NMR Offset 15.0036
NMR Spectrometer Frequency 250.134
Observed nucleus 1H
Origin 1H_ASIOH_7000_3135
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/7048854; Labnumber: SAD-E400073; IOH_ID: IOH-003136
Temperature 297 °C