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1-(5-cyano-1H-imidazol-4-yl)-5-methyl-triazole-4-carboxylic acid ethyl ester
SpectraBase Compound ID 8sykqZW3pzr
InChI InChI=1S/C10H10N6O2/c1-3-18-10(17)8-6(2)16(15-14-8)9-7(4-11)12-5-13-9/h5H,3H2,1-2H3,(H,12,13)
InChIKey GQEVLDUTNZAHAJ-UHFFFAOYSA-N
Mol Weight 246.23 g/mol
Molecular Formula C10H10N6O2
Exact Mass 246.086524 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID F7DTpW39Op5
Name 1-(5-cyano-1H-imidazol-4-yl)-5-methyl-triazole-4-carboxylic acid ethyl ester
Compound Number 7C
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C10H10N6O2
InChI InChI=1S/C10H10N6O2/c1-3-18-10(17)8-6(2)16(15-14-8)9-7(4-11)12-5-13-9/h5H,3H2,1-2H3,(H,12,13)
InChIKey GQEVLDUTNZAHAJ-UHFFFAOYSA-N
Literature Reference Author A.P.FREITAS,M.F.J.R.P.PROENCA,B.L.BOOTH
Literature Reference Citation J.HETCYCL.CHEM.,32,457(1995)
Literature Reference DOI 10.1002/jhet.5570320212
Molecular Weight 246.228 g/mol
Solvent DMSO-D6
Source File Reference UWMK267