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4-(4-Nitro-phenyl)-4H-1,2,4-triazole

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4-(4-Nitro-phenyl)-4H-1,2,4-triazole
SpectraBase Compound ID Beo4KwXxMXB
InChI InChI=1S/C8H6N4O2/c13-12(14)8-3-1-7(2-4-8)11-5-9-10-6-11/h1-6H
InChIKey ZERNWUNKACPDHD-UHFFFAOYSA-N
Mol Weight 190.16 g/mol
Molecular Formula C8H6N4O2
Exact Mass 190.049075 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4SYun3oJvl4
Name 4-(4-Nitro-phenyl)-4H-1,2,4-triazole
CAS Registry Number 16759-47-0
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C8H6N4O2
InChI InChI=1S/C8H6N4O2/c13-12(14)8-3-1-7(2-4-8)11-5-9-10-6-11/h1-6H
InChIKey ZERNWUNKACPDHD-UHFFFAOYSA-N
Instrument Name Varian CFT-20
Literature Reference M. Begtrup, J. Elguero, R. Faure, Magn. Res. Chem. 26, 134 (1988).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent DMSO-D6