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5-(4-Bromo-anilino)-1,2,3-triazole-4-carboxylic acid, ethyl ester
SpectraBase Compound ID CSOCG7PUhcj
InChI InChI=1S/C11H11BrN4O2/c1-2-18-11(17)9-10(15-16-14-9)13-8-5-3-7(12)4-6-8/h3-6H,2H2,1H3,(H2,13,14,15,16)
InChIKey IBWGXYYVNFNRLT-UHFFFAOYSA-N
Mol Weight 311.14 g/mol
Molecular Formula C11H11BrN4O2
Exact Mass 310.006539 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4KSWvo2n21G
Name 5-(4-Bromo-anilino)-1,2,3-triazole-4-carboxylic acid, ethyl ester
CAS Registry Number 106748-16-7
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C11H11BrN4O2
InChI InChI=1S/C11H11BrN4O2/c1-2-18-11(17)9-10(15-16-14-9)13-8-5-3-7(12)4-6-8/h3-6H,2H2,1H3,(H2,13,14,15,16)
InChIKey IBWGXYYVNFNRLT-UHFFFAOYSA-N
Instrument Name Bruker WH-90
Literature Reference H. Wamhoff, J. Bohlen, S.Y.Yang, Magn. Res. Chem. 24, 809 (1986).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent DMSO-D6