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(1-(4-chlorobenzyl)-1H-1,2,4-triazol-4-ium-4-yl)(nitro)amide
SpectraBase Compound ID B9DDD7ncDXH
InChI InChI=1S/C9H8ClN5O2/c10-9-3-1-8(2-4-9)5-13-7-14(6-11-13)12-15(16)17/h1-4,6-7H,5H2
InChIKey MJJUAAVBCAZFOR-UHFFFAOYSA-N
Mol Weight 253.65 g/mol
Molecular Formula C9H8ClN5O2
Exact Mass 253.036652 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID CWzxKDNe9kc
Name (1-(4-chlorobenzyl)-1H-1,2,4-triazol-4-ium-4-yl)(nitro)amide
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 253.036652216 u
Formula C9H8ClN5O2
InChI InChI=1S/C9H8ClN5O2/c10-9-3-1-8(2-4-9)5-13-7-14(6-11-13)12-15(16)17/h1-4,6-7H,5H2
InChIKey MJJUAAVBCAZFOR-UHFFFAOYSA-N
Molecular Weight 253.649 g/mol
NMR Offset 15.0036
NMR Spectrometer Frequency 250.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_2493
Solvent DMSO-d6
Source Vendor ID: NMR/9231327; Lab Info: L-42; Lab Number: L-42,Glushkov
Temperature 23.85 °C