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4-Amino-5-(2-chloro-benzoyl)-3H-1,2,3-triazole

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4-Amino-5-(2-chloro-benzoyl)-3H-1,2,3-triazole
SpectraBase Compound ID 8kqrFFLVB6H
InChI InChI=1S/C9H7ClN4O/c10-6-4-2-1-3-5(6)8(15)7-9(11)13-14-12-7/h1-4H,(H3,11,12,13,14)
InChIKey DDSDCLIWCHNARV-UHFFFAOYSA-N
Mol Weight 222.64 g/mol
Molecular Formula C9H7ClN4O
Exact Mass 222.030839 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EZxSbkHtaGr
Name 4-Amino-5-(2-chloro-benzoyl)-3H-1,2,3-triazole
CAS Registry Number 68221-25-0
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C9H7ClN4O
InChI InChI=1S/C9H7ClN4O/c10-6-4-2-1-3-5(6)8(15)7-9(11)13-14-12-7/h1-4H,(H3,11,12,13,14)
InChIKey DDSDCLIWCHNARV-UHFFFAOYSA-N
Instrument Name Varian XL-100
Literature Reference K.H. Weber, A. Langbein, Liebigs Ann. Chem. 1241 (1978).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent DMSO-D6