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1-(2-methoxyphenyl)-5-methyltriazole-4-carboxylic acid
SpectraBase Compound ID 9PBeUkuRoc7
InChI InChI=1S/C11H11N3O3/c1-7-10(11(15)16)12-13-14(7)8-5-3-4-6-9(8)17-2/h3-6H,1-2H3,(H,15,16)
InChIKey XDIJXIDIHIYINO-UHFFFAOYSA-N
Mol Weight 233.23 g/mol
Molecular Formula C11H11N3O3
Exact Mass 233.080041 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID AR3RzCNlT1d
Name 1-(2-methoxyphenyl)-5-methyltriazole-4-carboxylic acid
Compound Number 3J
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C11H11N3O3
InChI InChI=1S/C11H11N3O3/c1-7-10(11(15)16)12-13-14(7)8-5-3-4-6-9(8)17-2/h3-6H,1-2H3,(H,15,16)
InChIKey XDIJXIDIHIYINO-UHFFFAOYSA-N
Literature Reference Author X.W.SUN,P.F.XU,Z.Y.ZHANG
Literature Reference Citation MAGN.RES.CHEM.,36,459(1998)
Literature Reference DOI 10.1002/(sici)1097-458x(199806)36:6<459::aid-omr297>3.0.co;2-h
Molecular Weight 233.227 g/mol
Solvent DMSO-D6
Source File Reference UWRU1149